methyl 3-[(2-methylphenyl)carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[(2-methylphenyl)carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-nitro-5-(o-tolylcarbamoyl)benzoate CAS Name: 3-[(2-methylanilino)-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[(2-methylphenyl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-nitro-5-(o-tolylcarbamoyl)benzoic acid methyl ester Formula: C16H14N2O5 MolecularWeight: 314.29276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C16H14N2O5/c1-10-5-3-4-6-14(10)17-15(19)11-7-12(16(20)23-2)9-13(8-11)18(21)22/h3-9H,1-2H3,(H,17,19)