U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry MIXED
Molecular Formula C25H31NO3
Molecular Weight 393.5185
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METINDIZATE

SMILES

CN1CC(CCOC(=O)C(O)(C2=CC=CC=C2)C3=CC=CC=C3)C4CCCCC14

InChI

InChIKey=CCZXHOQYLPLQNP-UHFFFAOYSA-N
InChI=1S/C25H31NO3/c1-26-18-19(22-14-8-9-15-23(22)26)16-17-29-24(27)25(28,20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-7,10-13,19,22-23,28H,8-9,14-18H2,1H3

HIDE SMILES / InChI

Molecular Formula C25H31NO3
Molecular Weight 393.5185
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:53:49 GMT 2023
Edited
by admin
on Sat Dec 16 09:53:49 GMT 2023
Record UNII
L80J0CWN29
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METINDIZATE
INN  
INN  
Official Name English
metindizate [INN]
Common Name English
BENZENEACETIC ACID, .ALPHA.-HYDROXY-.ALPHA.-PHENYL-, 2-(OCTAHYDRO-1-METHYL-1H-INDOL-3-YL)ETHYL ESTER
Systematic Name English
Code System Code Type Description
ChEMBL
CHEMBL2104728
Created by admin on Sat Dec 16 09:53:49 GMT 2023 , Edited by admin on Sat Dec 16 09:53:49 GMT 2023
PRIMARY
EPA CompTox
DTXSID20864626
Created by admin on Sat Dec 16 09:53:49 GMT 2023 , Edited by admin on Sat Dec 16 09:53:49 GMT 2023
PRIMARY
CAS
15687-33-9
Created by admin on Sat Dec 16 09:53:49 GMT 2023 , Edited by admin on Sat Dec 16 09:53:49 GMT 2023
PRIMARY
FDA UNII
L80J0CWN29
Created by admin on Sat Dec 16 09:53:49 GMT 2023 , Edited by admin on Sat Dec 16 09:53:49 GMT 2023
PRIMARY
EVMPD
SUB08888MIG
Created by admin on Sat Dec 16 09:53:49 GMT 2023 , Edited by admin on Sat Dec 16 09:53:49 GMT 2023
PRIMARY
SMS_ID
100000080914
Created by admin on Sat Dec 16 09:53:49 GMT 2023 , Edited by admin on Sat Dec 16 09:53:49 GMT 2023
PRIMARY
INN
2042
Created by admin on Sat Dec 16 09:53:49 GMT 2023 , Edited by admin on Sat Dec 16 09:53:49 GMT 2023
PRIMARY
NCI_THESAURUS
C175817
Created by admin on Sat Dec 16 09:53:49 GMT 2023 , Edited by admin on Sat Dec 16 09:53:49 GMT 2023
PRIMARY
PUBCHEM
3047728
Created by admin on Sat Dec 16 09:53:49 GMT 2023 , Edited by admin on Sat Dec 16 09:53:49 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY