[2-methyl-4-(3-methylphenyl)phenyl] 4-methyl-3-nitro-benzoate

Systemtic Name: [2-methyl-4-(3-methylphenyl)phenyl] 4-methyl-3-nitro-benzoate Openeye Name: [2-methyl-4-(m-tolyl)phenyl] 4-methyl-3-nitro-benzoate CAS Name: 4-methyl-3-nitrobenzoic acid [2-methyl-4-(3-methylphenyl)phenyl] ester IUPAC Name: [2-methyl-4-(3-methylphenyl)phenyl] 4-methyl-3-nitrobenzoate Traditional Name: 4-methyl-3-nitro-benzoic acid [2-methyl-4-(m-tolyl)phenyl] ester Formula: C22H19NO4 MolecularWeight: 361.39056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)C3=CC(=CC=C3)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)C3=CC(=CC=C3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H19NO4/c1-14-5-4-6-17(11-14)18-9-10-21(16(3)12-18)27-22(24)19-8-7-15(2)20(13-19)23(25)26/h4-13H,1-3H3