(4-aminocarbonyl-2-nitro-phenyl)methyl 2-phenylbutanoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 2-phenylbutanoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 2-phenylbutanoate CAS Name: 2-phenylbutanoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 2-phenylbutanoate Traditional Name: 2-phenylbutyric acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C18H18N2O5 MolecularWeight: 342.34592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

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