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

Systemtic Name: methyl 5-di(butan-2-yloxy)phosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-disec-butoxyphosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 5-di(butan-2-yloxy)phosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-di(butan-2-yloxy)phosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-disec-butoxyphosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C23H33N2O7P MolecularWeight: 480.491081

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H33N2O7P/c1-8-14(3)31-33(29,32-15(4)9-2)22-17(6)24-16(5)20(23(26)30-7)21(22)18-11-10-12-19(13-18)25(27)28/h10-15,21,24H,8-9H2,1-7H3