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

Systemtic Name: 5-ethoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-1-(phenylmethyl)-4H-pyridine-3-carboxylic acid Openeye Name: 1-benzyl-5-ethoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid CAS Name: 5-ethoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-1-(phenylmethyl)-4H-pyridine-3-carboxylic acid IUPAC Name: 1-benzyl-5-ethoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid Traditional Name: 1-benzyl-5-carbethoxy-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid Formula: C24H24N2O6 MolecularWeight: 436.45716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O)C)CC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O)C)CC3=CC=CC=C3)C

InChI

InChI=1S/C24H24N2O6/c1-4-32-24(29)21-16(3)25(14-17-9-6-5-7-10-17)15(2)20(23(27)28)22(21)18-11-8-12-19(13-18)26(30)31/h5-13,22H,4,14H2,1-3H3,(H,27,28)