(4-phenylphenyl)methyl 2-methyl-3-nitro-benzoate

Systemtic Name: (4-phenylphenyl)methyl 2-methyl-3-nitro-benzoate Openeye Name: (4-phenylphenyl)methyl 2-methyl-3-nitro-benzoate CAS Name: 2-methyl-3-nitrobenzoic acid (4-phenylphenyl)methyl ester IUPAC Name: (4-phenylphenyl)methyl 2-methyl-3-nitrobenzoate Traditional Name: 2-methyl-3-nitro-benzoic acid (4-phenylbenzyl) ester Formula: C21H17NO4 MolecularWeight: 347.36398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H17NO4/c1-15-19(8-5-9-20(15)22(24)25)21(23)26-14-16-10-12-18(13-11-16)17-6-3-2-4-7-17/h2-13H,14H2,1H3