diethyl 2-methyl-4-(2-nitrophenyl)-6-(3-oxidanyl-3-phenyl-propyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl 2-methyl-4-(2-nitrophenyl)-6-(3-oxidanyl-3-phenyl-propyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 2-(3-hydroxy-3-phenyl-propyl)-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-(3-hydroxy-3-phenylpropyl)-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-(3-hydroxy-3-phenylpropyl)-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-(3-hydroxy-3-phenyl-propyl)-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C27H30N2O7 MolecularWeight: 494.5363

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H30N2O7/c1-4-35-26(31)23-17(3)28-20(15-16-22(30)18-11-7-6-8-12-18)25(27(32)36-5-2)24(23)19-13-9-10-14-21(19)29(33)34/h6-14,22,24,28,30H,4-5,15-16H2,1-3H3