2-cyano-3-methoxycarbonyl-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-5-carboxylic acid

Systemtic Name: 2-cyano-3-methoxycarbonyl-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-5-carboxylic acid Openeye Name: 2-cyano-3-methoxycarbonyl-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-5-carboxylic acid CAS Name: 2-cyano-3-methoxycarbonyl-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-5-carboxylic acid IUPAC Name: 2-cyano-3-methoxycarbonyl-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-5-carboxylic acid Traditional Name: 3-carbomethoxy-2-cyano-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-5-carboxylic acid Formula: C16H15N3O6 MolecularWeight: 345.3068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(N1)C#N)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC)C(=O)O

Isomeric SMILES

CC1=C(CC(C(N1)C#N)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC)C(=O)O

InChI

InChI=1S/C16H15N3O6/c1-9-12(14(20)21)7-16(15(22)25-2,13(8-17)18-9)10-3-5-11(6-4-10)19(23)24/h3-6,13,18H,7H2,1-2H3,(H,20,21)