2-[[4-(4-methylphenyl)carbonylphenyl]-nitroso-amino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[[4-(4-methylphenyl)carbonylphenyl]-nitroso-amino]-2-phenyl-ethanoic acid Openeye Name: 2-[4-(4-methylbenzoyl)-N-nitroso-anilino]-2-phenyl-acetic acid CAS Name: 2-[4-[(4-methylphenyl)-oxomethyl]-N-nitrosoanilino]-2-phenylacetic acid IUPAC Name: 2-[4-(4-methylbenzoyl)-N-nitrosoanilino]-2-phenylacetic acid Traditional Name: 2-(N-nitroso-4-p-toluoyl-anilino)-2-phenyl-acetic acid Formula: C22H18N2O4 MolecularWeight: 374.38932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)N(C(C3=CC=CC=C3)C(=O)O)N=O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)N(C(C3=CC=CC=C3)C(=O)O)N=O

InChI

InChI=1S/C22H18N2O4/c1-15-7-9-17(10-8-15)21(25)18-11-13-19(14-12-18)24(23-28)20(22(26)27)16-5-3-2-4-6-16/h2-14,20H,1H3,(H,26,27)