(2-naphthalen-2-yl-2-oxidanylidene-ethyl) 5-ethoxy-4-methoxy-2-nitro-benzoate

Systemtic Name: (2-naphthalen-2-yl-2-oxidanylidene-ethyl) 5-ethoxy-4-methoxy-2-nitro-benzoate Openeye Name: [2-(2-naphthyl)-2-oxo-ethyl] 5-ethoxy-4-methoxy-2-nitro-benzoate CAS Name: 5-ethoxy-4-methoxy-2-nitrobenzoic acid [2-(2-naphthalenyl)-2-oxoethyl] ester IUPAC Name: (2-naphthalen-2-yl-2-oxoethyl) 5-ethoxy-4-methoxy-2-nitrobenzoate Traditional Name: 5-ethoxy-4-methoxy-2-nitro-benzoic acid [2-keto-2-(2-naphthyl)ethyl] ester Formula: C22H19NO7 MolecularWeight: 409.38876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)OCC(=O)C2=CC3=CC=CC=C3C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)OCC(=O)C2=CC3=CC=CC=C3C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C22H19NO7/c1-3-29-21-11-17(18(23(26)27)12-20(21)28-2)22(25)30-13-19(24)16-9-8-14-6-4-5-7-15(14)10-16/h4-12H,3,13H2,1-2H3