[4-chloranyl-2-(phenylmethyl)phenyl] 3-nitrobenzoate

Systemtic Name: [4-chloranyl-2-(phenylmethyl)phenyl] 3-nitrobenzoate Openeye Name: (2-benzyl-4-chloro-phenyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-chloro-2-(phenylmethyl)phenyl] ester IUPAC Name: (2-benzyl-4-chlorophenyl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (2-benzyl-4-chloro-phenyl) ester Formula: C20H14ClNO4 MolecularWeight: 367.78246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H14ClNO4/c21-17-9-10-19(16(12-17)11-14-5-2-1-3-6-14)26-20(23)15-7-4-8-18(13-15)22(24)25/h1-10,12-13H,11H2