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Details

Stereochemistry RACEMIC
Molecular Formula C16H16N2O6
Molecular Weight 332.3087
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,6-DIMETHYL-5-METHOXYCARBONYL-4-(3-NITROPHENYL)-1,4-DIHYDROPYRIDINE-3-CARBOXYLIC ACID

SMILES

CC1=C(C(c2cccc(c2)N(=O)=O)C(=C(C)N1)C(=O)OC)C(=O)O

InChI

InChIKey=JPXPPUOCSLMCHK-UHFFFAOYSA-N
InChI=1S/C16H16N2O6/c1-8-12(15(19)20)14(13(9(2)17-8)16(21)24-3)10-5-4-6-11(7-10)18(22)23/h4-7,14,17H,1-3H3,(H,19,20)

HIDE SMILES / InChI

Molecular Formula C16H16N2O6
Molecular Weight 332.3087
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Jun 26 10:14:35 UTC 2021
Edited
by admin
on Sat Jun 26 10:14:35 UTC 2021
Record UNII
5DU0E310OI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,6-DIMETHYL-5-METHOXYCARBONYL-4-(3-NITROPHENYL)-1,4-DIHYDROPYRIDINE-3-CARBOXYLIC ACID
Systematic Name English
5-(METHOXYCARBONYL)-2,6-DIMETHYL-4-(3-NITROPHENYL)-1,4-DIHYDROPYRIDINE-3-CARBOXYLIC ACID
Systematic Name English
3,5-PYRIDINEDICARBOXYLIC ACID, 1,4-DIHYDRO-2,6-DIMETHYL-4-(3-NITROPHENYL)-, 3-METHYL ESTER
Common Name English
(+/-)-1,4-DIHYDRO-5-METHOXYCARBONYL-2,6-DIMETHYL-4-(3-NITROPHENYL)-3-PYRIDINECARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
PUBCHEM
173322
Created by admin on Sat Jun 26 10:14:35 UTC 2021 , Edited by admin on Sat Jun 26 10:14:35 UTC 2021
PRIMARY
ECHA (EC/EINECS)
278-034-2
Created by admin on Sat Jun 26 10:14:35 UTC 2021 , Edited by admin on Sat Jun 26 10:14:35 UTC 2021
PRIMARY
CAS
74936-72-4
Created by admin on Sat Jun 26 10:14:35 UTC 2021 , Edited by admin on Sat Jun 26 10:14:35 UTC 2021
PRIMARY
FDA UNII
5DU0E310OI
Created by admin on Sat Jun 26 10:14:35 UTC 2021 , Edited by admin on Sat Jun 26 10:14:35 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
PARENT -> IMPURITY