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

Systemtic Name: [2-methyl-4-(3-methylphenyl)phenyl] 4-nitrobenzoate Openeye Name: [2-methyl-4-(m-tolyl)phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-methyl-4-(3-methylphenyl)phenyl] ester IUPAC Name: [2-methyl-4-(3-methylphenyl)phenyl] 4-nitrobenzoate Traditional Name: 4-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=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

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

InChI

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