[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl] 4-[bis(fluoranyl)methoxy]-5-methoxy-2-nitro-benzoate

Systemtic Name: [2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl] 4-[bis(fluoranyl)methoxy]-5-methoxy-2-nitro-benzoate Openeye Name: [2-(1-naphthylamino)-2-oxo-ethyl] 4-(difluoromethoxy)-5-methoxy-2-nitro-benzoate CAS Name: 4-(difluoromethoxy)-5-methoxy-2-nitrobenzoic acid [2-(1-naphthalenylamino)-2-oxoethyl] ester IUPAC Name: [2-(naphthalen-1-ylamino)-2-oxoethyl] 4-(difluoromethoxy)-5-methoxy-2-nitrobenzoate Traditional Name: 4-(difluoromethoxy)-5-methoxy-2-nitro-benzoic acid [2-keto-2-(1-naphthylamino)ethyl] ester Formula: C21H16F2N2O7 MolecularWeight: 446.357746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCC(=O)NC2=CC=CC3=CC=CC=C32)[N+](=O)[O-])OC(F)F

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCC(=O)NC2=CC=CC3=CC=CC=C32)[N+](=O)[O-])OC(F)F

InChI

InChI=1S/C21H16F2N2O7/c1-30-17-9-14(16(25(28)29)10-18(17)32-21(22)23)20(27)31-11-19(26)24-15-8-4-6-12-5-2-3-7-13(12)15/h2-10,21H,11H2,1H3,(H,24,26)