[2-methyl-4-(3-methylphenyl)phenyl] 2-nitrobenzoate

Systemtic Name: [2-methyl-4-(3-methylphenyl)phenyl] 2-nitrobenzoate Openeye Name: [2-methyl-4-(m-tolyl)phenyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [2-methyl-4-(3-methylphenyl)phenyl] ester IUPAC Name: [2-methyl-4-(3-methylphenyl)phenyl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [2-methyl-4-(m-tolyl)phenyl] ester Formula: C21H17NO4 MolecularWeight: 347.36398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3[N+](=O)[O-])C

InChI

InChI=1S/C21H17NO4/c1-14-6-5-7-16(12-14)17-10-11-20(15(2)13-17)26-21(23)18-8-3-4-9-19(18)22(24)25/h3-13H,1-2H3