4-[(3-methylphenyl)-nitroso-amino]benzoic acid

Systemtic Name: 4-[(3-methylphenyl)-nitroso-amino]benzoic acid Openeye Name: 4-(3-methyl-N-nitroso-anilino)benzoic acid CAS Name: 4-(3-methyl-N-nitrosoanilino)benzoic acid IUPAC Name: 4-(3-methyl-N-nitrosoanilino)benzoic acid Traditional Name: 4-(3-methyl-N-nitroso-anilino)benzoic acid Formula: C14H12N2O3 MolecularWeight: 256.25668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(C2=CC=C(C=C2)C(=O)O)N=O

Isomeric SMILES

CC1=CC(=CC=C1)N(C2=CC=C(C=C2)C(=O)O)N=O

InChI

InChI=1S/C14H12N2O3/c1-10-3-2-4-13(9-10)16(15-19)12-7-5-11(6-8-12)14(17)18/h2-9H,1H3,(H,17,18)