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Details

Stereochemistry ACHIRAL
Molecular Formula C17H16N2O7
Molecular Weight 360.3181
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Carboxy-6-hydroxymethyl-dehydronitrendipine

SMILES

CCOC(=O)C1=C(C)N=C(CO)C(C(O)=O)=C1C2=CC(=CC=C2)[N+]([O-])=O

InChI

InChIKey=URTGKNDSXSLLRZ-UHFFFAOYSA-N
InChI=1S/C17H16N2O7/c1-3-26-17(23)13-9(2)18-12(8-20)15(16(21)22)14(13)10-5-4-6-11(7-10)19(24)25/h4-7,20H,3,8H2,1-2H3,(H,21,22)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
5-Carboxy-6-hydroxymethyl-dehydronitrendipine
Common Name English
5-Ethyl 2-(hydroxymethyl)-6-methyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate
Systematic Name English
5-(Ethoxycarbonyl)-2-(hydroxymethyl)-6-methyl-4-(3-nitrophenyl)nicotinic acid
Systematic Name English
3,5-Pyridinedicarboxylic acid, 2-(hydroxymethyl)-6-methyl-4-(3-nitrophenyl)-, 5-ethyl ester
Systematic Name English
Code System Code Type Description
CAS
89267-43-6
Created by admin on Sat Dec 16 19:53:19 GMT 2023 , Edited by admin on Sat Dec 16 19:53:19 GMT 2023
PRIMARY
PUBCHEM
54368907
Created by admin on Sat Dec 16 19:53:19 GMT 2023 , Edited by admin on Sat Dec 16 19:53:19 GMT 2023
PRIMARY
FDA UNII
88B3C46ZBQ
Created by admin on Sat Dec 16 19:53:19 GMT 2023 , Edited by admin on Sat Dec 16 19:53:19 GMT 2023
PRIMARY
NIH
NCATS
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