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Details

Stereochemistry ACHIRAL
Molecular Formula C20H22N2O7
Molecular Weight 402.3987
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(2-HYDROXYETHYL) 5-ISOPROPYL 2,6-DIMETHYL-4-(3-NITROPHENYL)PYRIDINE-3,5-DICARBOXYLATE

SMILES

CC(C)OC(=O)c1c(C)nc(C)c(c1-c2cccc(c2)N(=O)=O)C(=O)OCCO

InChI

InChIKey=PWPBMCUBOQNEJD-UHFFFAOYSA-N
InChI=1S/C20H22N2O7/c1-11(2)29-20(25)17-13(4)21-12(3)16(19(24)28-9-8-23)18(17)14-6-5-7-15(10-14)22(26)27/h5-7,10-11,23H,8-9H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C20H22N2O7
Molecular Weight 402.3987
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 05:23:24 UTC 2021
Edited
by admin
on Sat Jun 26 05:23:24 UTC 2021
Record UNII
96S4GG1UPR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(2-HYDROXYETHYL) 5-ISOPROPYL 2,6-DIMETHYL-4-(3-NITROPHENYL)PYRIDINE-3,5-DICARBOXYLATE
Systematic Name English
NIMODIPINE (M3)
Common Name English
3,5-PYRIDINEDICARBOXYLIC ACID, 2,6-DIMETHYL-4-(3-NITROPHENYL)-, 3-(2-HYDROXYETHYL) 5-(1-METHYLETHYL) ESTER
Systematic Name English
Code System Code Type Description
FDA UNII
96S4GG1UPR
Created by admin on Sat Jun 26 05:23:24 UTC 2021 , Edited by admin on Sat Jun 26 05:23:24 UTC 2021
PRIMARY
CAS
82219-48-5
Created by admin on Sat Jun 26 05:23:24 UTC 2021 , Edited by admin on Sat Jun 26 05:23:24 UTC 2021
PRIMARY
PUBCHEM
10431202
Created by admin on Sat Jun 26 05:23:24 UTC 2021 , Edited by admin on Sat Jun 26 05:23:24 UTC 2021
PRIMARY
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