methyl 5-diphenoxyphosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 5-diphenoxyphosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-diphenoxyphosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 5-diphenoxyphosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-diphenoxyphosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-diphenoxyphosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C27H25N2O7P MolecularWeight: 520.470361

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C27H25N2O7P/c1-18-24(27(30)34-3)25(20-11-10-12-21(17-20)29(31)32)26(19(2)28-18)37(33,35-22-13-6-4-7-14-22)36-23-15-8-5-9-16-23/h4-17,25,28H,1-3H3