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

Systemtic Name: 2-phenylmethoxyethyl 5-di(propan-2-yloxy)phosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: 2-benzyloxyethyl 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 2-phenylmethoxyethyl ester IUPAC Name: 2-phenylmethoxyethyl 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 2-benzoxyethyl ester Formula: C29H37N2O8P MolecularWeight: 572.586441

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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)OCCOCC3=CC=CC=C3

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)OCCOCC3=CC=CC=C3

InChI

InChI=1S/C29H37N2O8P/c1-19(2)38-40(35,39-20(3)4)28-22(6)30-21(5)26(27(28)24-13-10-14-25(17-24)31(33)34)29(32)37-16-15-36-18-23-11-8-7-9-12-23/h7-14,17,19-20,27,30H,15-16,18H2,1-6H3