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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H23NO2
Molecular Weight 261.3593
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-ETHYLHEXAHYDRO-3-(3-METHOXYPHENYL)-1-METHYL-2H-AZEPIN-2-ONE, (R)-

SMILES

CC[C@@]1(CCCCN(C)C1=O)C2=CC=CC(OC)=C2

InChI

InChIKey=AFBQUXAODCBPRJ-MRXNPFEDSA-N
InChI=1S/C16H23NO2/c1-4-16(10-5-6-11-17(2)15(16)18)13-8-7-9-14(12-13)19-3/h7-9,12H,4-6,10-11H2,1-3H3/t16-/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H23NO2
Molecular Weight 261.3593
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:56:32 GMT 2023
Edited
by admin
on Sat Dec 16 11:56:32 GMT 2023
Record UNII
2Y3CB4SY5P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-ETHYLHEXAHYDRO-3-(3-METHOXYPHENYL)-1-METHYL-2H-AZEPIN-2-ONE, (R)-
Systematic Name English
2H-AZEPIN-2-ONE, 3-ETHYLHEXAHYDRO-3-(3-METHOXYPHENYL)-1-METHYL-, (+)-
Systematic Name English
2H-AZEPIN-2-ONE, 3-ETHYLHEXAHYDRO-3-(3-METHOXYPHENYL)-1-METHYL-, (3R)-
Systematic Name English
Code System Code Type Description
CAS
275807-86-8
Created by admin on Sat Dec 16 11:56:32 GMT 2023 , Edited by admin on Sat Dec 16 11:56:32 GMT 2023
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FDA UNII
2Y3CB4SY5P
Created by admin on Sat Dec 16 11:56:32 GMT 2023 , Edited by admin on Sat Dec 16 11:56:32 GMT 2023
PRIMARY
PUBCHEM
6923849
Created by admin on Sat Dec 16 11:56:32 GMT 2023 , Edited by admin on Sat Dec 16 11:56:32 GMT 2023
PRIMARY