ethyl 5-di(propan-2-yloxy)phosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 5-di(propan-2-yloxy)phosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 5-diisopropoxyphosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 5-di(propan-2-yloxy)phosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-di(propan-2-yloxy)phosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-diisopropoxyphosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C22H31N2O7P MolecularWeight: 466.464501

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])P(=O)(OC(C)C)OC(C)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])P(=O)(OC(C)C)OC(C)C)C)C

InChI

InChI=1S/C22H31N2O7P/c1-8-29-22(25)19-15(6)23-16(7)21(32(28,30-13(2)3)31-14(4)5)20(19)17-10-9-11-18(12-17)24(26)27/h9-14,20,23H,8H2,1-7H3