methyl 5-nitro-2-(phenylmethyl)benzoate

Systemtic Name: methyl 5-nitro-2-(phenylmethyl)benzoate Openeye Name: methyl 2-benzyl-5-nitro-benzoate CAS Name: 5-nitro-2-(phenylmethyl)benzoic acid methyl ester IUPAC Name: methyl 2-benzyl-5-nitrobenzoate Traditional Name: 2-benzyl-5-nitro-benzoic acid methyl ester Formula: C15H13NO4 MolecularWeight: 271.26802

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])CC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])CC2=CC=CC=C2

InChI

InChI=1S/C15H13NO4/c1-20-15(17)14-10-13(16(18)19)8-7-12(14)9-11-5-3-2-4-6-11/h2-8,10H,9H2,1H3