pentyl 3-acetamido-2,6-dimethyl-5-nitro-4-(2-phenylmethoxyphenyl)-2,4-dihydro-1H-pyridine-3-carboxylate

Systemtic Name: pentyl 3-acetamido-2,6-dimethyl-5-nitro-4-(2-phenylmethoxyphenyl)-2,4-dihydro-1H-pyridine-3-carboxylate Openeye Name: pentyl 3-acetamido-4-(2-benzyloxyphenyl)-2,6-dimethyl-5-nitro-2,4-dihydro-1H-pyridine-3-carboxylate CAS Name: 3-acetamido-2,6-dimethyl-5-nitro-4-(2-phenylmethoxyphenyl)-2,4-dihydro-1H-pyridine-3-carboxylic acid pentyl ester IUPAC Name: pentyl 3-acetamido-2,6-dimethyl-5-nitro-4-(2-phenylmethoxyphenyl)-2,4-dihydro-1H-pyridine-3-carboxylate Traditional Name: 3-acetamido-4-(2-benzoxyphenyl)-2,6-dimethyl-5-nitro-2,4-dihydro-1H-pyridine-3-carboxylic acid amyl ester Formula: C28H35N3O6 MolecularWeight: 509.594

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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)NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C28H35N3O6/c1-5-6-12-17-36-27(33)28(30-21(4)32)20(3)29-19(2)26(31(34)35)25(28)23-15-10-11-16-24(23)37-18-22-13-8-7-9-14-22/h7-11,13-16,20,25,29H,5-6,12,17-18H2,1-4H3,(H,30,32)