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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17NO4/c1-15-7-9-17(10-8-15)20(16-5-3-2-4-6-16)26-21(23)18-11-13-19(14-12-18)22(24)25/h2-14,20H,1H3