4-[[(3-methyl-4-nitro-phenyl)carbonylamino]methyl]benzoate

Systemtic Name: 4-[[(3-methyl-4-nitro-phenyl)carbonylamino]methyl]benzoate Openeye Name: 4-[[(3-methyl-4-nitro-benzoyl)amino]methyl]benzoate CAS Name: 4-[[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]methyl]benzoate IUPAC Name: 4-[[(3-methyl-4-nitrobenzoyl)amino]methyl]benzoate Traditional Name: 4-[[(3-methyl-4-nitro-benzoyl)amino]methyl]benzoate Formula: C16H13N2O5- MolecularWeight: 313.28482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC2=CC=C(C=C2)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC2=CC=C(C=C2)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O5/c1-10-8-13(6-7-14(10)18(22)23)15(19)17-9-11-2-4-12(5-3-11)16(20)21/h2-8H,9H2,1H3,(H,17,19)(H,20,21)/p-1