diethyl 4-(2-decyl-6-methoxy-3-nitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl 4-(2-decyl-6-methoxy-3-nitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 4-(2-decyl-6-methoxy-3-nitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(2-decyl-6-methoxy-3-nitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(2-decyl-6-methoxy-3-nitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2-decyl-6-methoxy-3-nitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C30H44N2O7 MolecularWeight: 544.67956

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=C(C=CC(=C1C2C(=C(NC(=C2C(=O)OCC)C)C)C(=O)OCC)OC)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCC1=C(C=CC(=C1C2C(=C(NC(=C2C(=O)OCC)C)C)C(=O)OCC)OC)[N+](=O)[O-]

InChI

InChI=1S/C30H44N2O7/c1-7-10-11-12-13-14-15-16-17-22-23(32(35)36)18-19-24(37-6)27(22)28-25(29(33)38-8-2)20(4)31-21(5)26(28)30(34)39-9-3/h18-19,28,31H,7-17H2,1-6H3