(phenylmethyl) 2-[(3-methyl-4-nitro-phenyl)carbonylamino]ethanoate

Systemtic Name: (phenylmethyl) 2-[(3-methyl-4-nitro-phenyl)carbonylamino]ethanoate Openeye Name: benzyl 2-[(3-methyl-4-nitro-benzoyl)amino]acetate CAS Name: 2-[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate Traditional Name: 2-[(3-methyl-4-nitro-benzoyl)amino]acetic acid benzyl ester Formula: C17H16N2O5 MolecularWeight: 328.31934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC(=O)OCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC(=O)OCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O5/c1-12-9-14(7-8-15(12)19(22)23)17(21)18-10-16(20)24-11-13-5-3-2-4-6-13/h2-9H,10-11H2,1H3,(H,18,21)