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

Systemtic Name: methyl 5-di(propan-2-yloxy)phosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C21H29N2O7P MolecularWeight: 452.437921

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N2O7P/c1-12(2)29-31(27,30-13(3)4)20-15(6)22-14(5)18(21(24)28-7)19(20)16-9-8-10-17(11-16)23(25)26/h8-13,19,22H,1-7H3