(4-nitrophenyl) 3-acetamido-3-(4-methylphenyl)propanoate

Systemtic Name: (4-nitrophenyl) 3-acetamido-3-(4-methylphenyl)propanoate Openeye Name: (4-nitrophenyl) 3-acetamido-3-(p-tolyl)propanoate CAS Name: 3-acetamido-3-(4-methylphenyl)propanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 3-acetamido-3-(4-methylphenyl)propanoate Traditional Name: 3-acetamido-3-(p-tolyl)propionic acid (4-nitrophenyl) ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C

InChI

InChI=1S/C18H18N2O5/c1-12-3-5-14(6-4-12)17(19-13(2)21)11-18(22)25-16-9-7-15(8-10-16)20(23)24/h3-10,17H,11H2,1-2H3,(H,19,21)