[2-(phenylmethyl)phenyl] 4-methoxy-3-nitro-benzoate

Systemtic Name: [2-(phenylmethyl)phenyl] 4-methoxy-3-nitro-benzoate Openeye Name: (2-benzylphenyl) 4-methoxy-3-nitro-benzoate CAS Name: 4-methoxy-3-nitrobenzoic acid [2-(phenylmethyl)phenyl] ester IUPAC Name: (2-benzylphenyl) 4-methoxy-3-nitrobenzoate Traditional Name: 4-methoxy-3-nitro-benzoic acid (2-benzylphenyl) ester Formula: C21H17NO5 MolecularWeight: 363.36338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H17NO5/c1-26-20-12-11-17(14-18(20)22(24)25)21(23)27-19-10-6-5-9-16(19)13-15-7-3-2-4-8-15/h2-12,14H,13H2,1H3