2-methylpropyl 1-[(3-cyanophenyl)methyl]-6-methyl-4-(3-nitrophenyl)-2-oxidanylidene-3,4-dihydropyridine-5-carboxylate

Systemtic Name: 2-methylpropyl 1-[(3-cyanophenyl)methyl]-6-methyl-4-(3-nitrophenyl)-2-oxidanylidene-3,4-dihydropyridine-5-carboxylate Openeye Name: isobutyl 1-[(3-cyanophenyl)methyl]-6-methyl-4-(3-nitrophenyl)-2-oxo-3,4-dihydropyridine-5-carboxylate CAS Name: 1-[(3-cyanophenyl)methyl]-6-methyl-4-(3-nitrophenyl)-2-oxo-3,4-dihydropyridine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 1-[(3-cyanophenyl)methyl]-6-methyl-4-(3-nitrophenyl)-2-oxo-3,4-dihydropyridine-5-carboxylate Traditional Name: 1-(3-cyanobenzyl)-2-keto-6-methyl-4-(3-nitrophenyl)-3,4-dihydropyridine-5-carboxylic acid isobutyl ester Formula: C25H25N3O5 MolecularWeight: 447.4831

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC(=O)N1CC2=CC=CC(=C2)C#N)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCC(C)C

Isomeric SMILES

CC1=C(C(CC(=O)N1CC2=CC=CC(=C2)C#N)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCC(C)C

InChI

InChI=1S/C25H25N3O5/c1-16(2)15-33-25(30)24-17(3)27(14-19-7-4-6-18(10-19)13-26)23(29)12-22(24)20-8-5-9-21(11-20)28(31)32/h4-11,16,22H,12,14-15H2,1-3H3