2-[(4-methylphenyl)carbamoyl]-3-nitro-benzoate

Systemtic Name: 2-[(4-methylphenyl)carbamoyl]-3-nitro-benzoate Openeye Name: 3-nitro-2-(p-tolylcarbamoyl)benzoate CAS Name: 2-[(4-methylanilino)-oxomethyl]-3-nitrobenzoate IUPAC Name: 2-[(4-methylphenyl)carbamoyl]-3-nitrobenzoate Traditional Name: 3-nitro-2-(p-tolylcarbamoyl)benzoate Formula: C15H11N2O5- MolecularWeight: 299.25824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12N2O5/c1-9-5-7-10(8-6-9)16-14(18)13-11(15(19)20)3-2-4-12(13)17(21)22/h2-8H,1H3,(H,16,18)(H,19,20)/p-1