(2-naphthalen-2-yl-2-oxidanylidene-ethyl) 2-methyl-3-nitro-benzoate

Systemtic Name: (2-naphthalen-2-yl-2-oxidanylidene-ethyl) 2-methyl-3-nitro-benzoate Openeye Name: [2-(2-naphthyl)-2-oxo-ethyl] 2-methyl-3-nitro-benzoate CAS Name: 2-methyl-3-nitrobenzoic acid [2-(2-naphthalenyl)-2-oxoethyl] ester IUPAC Name: (2-naphthalen-2-yl-2-oxoethyl) 2-methyl-3-nitrobenzoate Traditional Name: 2-methyl-3-nitro-benzoic acid [2-keto-2-(2-naphthyl)ethyl] ester Formula: C20H15NO5 MolecularWeight: 349.3368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)OCC(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)OCC(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H15NO5/c1-13-17(7-4-8-18(13)21(24)25)20(23)26-12-19(22)16-10-9-14-5-2-3-6-15(14)11-16/h2-11H,12H2,1H3