pentyl 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-2,6-dimethyl-5-nitro-4-(2-phenylmethoxyphenyl)-2,4-dihydro-1H-pyridine-3-carboxylate

Systemtic Name: pentyl 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-2,6-dimethyl-5-nitro-4-(2-phenylmethoxyphenyl)-2,4-dihydro-1H-pyridine-3-carboxylate Openeye Name: pentyl 4-(2-benzyloxyphenyl)-3-(1,3-dioxoisoindolin-2-yl)-2,6-dimethyl-5-nitro-2,4-dihydro-1H-pyridine-3-carboxylate CAS Name: 3-(1,3-dioxo-2-isoindolyl)-2,6-dimethyl-5-nitro-4-(2-phenylmethoxyphenyl)-2,4-dihydro-1H-pyridine-3-carboxylic acid pentyl ester IUPAC Name: pentyl 3-(1,3-dioxoisoindol-2-yl)-2,6-dimethyl-5-nitro-4-(2-phenylmethoxyphenyl)-2,4-dihydro-1H-pyridine-3-carboxylate Traditional Name: 4-(2-benzoxyphenyl)-2,6-dimethyl-5-nitro-3-phthalimido-2,4-dihydro-1H-pyridine-3-carboxylic acid amyl ester Formula: C34H35N3O7 MolecularWeight: 597.6576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1(C(NC(=C(C1C2=CC=CC=C2OCC3=CC=CC=C3)[N+](=O)[O-])C)C)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CCCCCOC(=O)C1(C(NC(=C(C1C2=CC=CC=C2OCC3=CC=CC=C3)[N+](=O)[O-])C)C)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C34H35N3O7/c1-4-5-13-20-43-33(40)34(36-31(38)25-16-9-10-17-26(25)32(36)39)23(3)35-22(2)30(37(41)42)29(34)27-18-11-12-19-28(27)44-21-24-14-7-6-8-15-24/h6-12,14-19,23,29,35H,4-5,13,20-21H2,1-3H3