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

Systemtic Name: 5-methoxycarbonyl-3,6-dimethyl-4-(3-nitrophenyl)-2,4-dihydro-1H-pyridine-3-carboxylic acid Openeye Name: 5-methoxycarbonyl-3,6-dimethyl-4-(3-nitrophenyl)-2,4-dihydro-1H-pyridine-3-carboxylic acid CAS Name: 5-methoxycarbonyl-3,6-dimethyl-4-(3-nitrophenyl)-2,4-dihydro-1H-pyridine-3-carboxylic acid IUPAC Name: 5-methoxycarbonyl-3,6-dimethyl-4-(3-nitrophenyl)-2,4-dihydro-1H-pyridine-3-carboxylic acid Traditional Name: 5-carbomethoxy-3,6-dimethyl-4-(3-nitrophenyl)-2,4-dihydro-1H-pyridine-3-carboxylic acid Formula: C16H18N2O6 MolecularWeight: 334.32392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(CN1)(C)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C(CN1)(C)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C16H18N2O6/c1-9-12(14(19)24-3)13(16(2,8-17-9)15(20)21)10-5-4-6-11(7-10)18(22)23/h4-7,13,17H,8H2,1-3H3,(H,20,21)