(3-methylphenyl)methyl 3-[(4-nitrophenyl)carbonylamino]propanoate

Systemtic Name: (3-methylphenyl)methyl 3-[(4-nitrophenyl)carbonylamino]propanoate Openeye Name: m-tolylmethyl 3-[(4-nitrobenzoyl)amino]propanoate CAS Name: 3-[[(4-nitrophenyl)-oxomethyl]amino]propanoic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 3-[(4-nitrobenzoyl)amino]propanoate Traditional Name: 3-[(4-nitrobenzoyl)amino]propionic acid (3-methylbenzyl) ester Formula: C18H18N2O5 MolecularWeight: 342.34592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)COC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O5/c1-13-3-2-4-14(11-13)12-25-17(21)9-10-19-18(22)15-5-7-16(8-6-15)20(23)24/h2-8,11H,9-10,12H2,1H3,(H,19,22)