(2-naphthalen-2-yl-2-oxidanylidene-ethyl) 4-(dimethylamino)-3-nitro-benzoate

Systemtic Name: (2-naphthalen-2-yl-2-oxidanylidene-ethyl) 4-(dimethylamino)-3-nitro-benzoate Openeye Name: [2-(2-naphthyl)-2-oxo-ethyl] 4-(dimethylamino)-3-nitro-benzoate CAS Name: 4-(dimethylamino)-3-nitrobenzoic acid [2-(2-naphthalenyl)-2-oxoethyl] ester IUPAC Name: (2-naphthalen-2-yl-2-oxoethyl) 4-(dimethylamino)-3-nitrobenzoate Traditional Name: 4-(dimethylamino)-3-nitro-benzoic acid [2-keto-2-(2-naphthyl)ethyl] ester Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N2O5/c1-22(2)18-10-9-17(12-19(18)23(26)27)21(25)28-13-20(24)16-8-7-14-5-3-4-6-15(14)11-16/h3-12H,13H2,1-2H3