[1-(naphthalen-1-ylamino)-1-oxidanylidene-propan-2-yl] 4-cyanobenzoate

Systemtic Name: [1-(naphthalen-1-ylamino)-1-oxidanylidene-propan-2-yl] 4-cyanobenzoate Openeye Name: [1-methyl-2-(1-naphthylamino)-2-oxo-ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [1-(1-naphthalenylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(naphthalen-1-ylamino)-1-oxopropan-2-yl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-keto-1-methyl-2-(1-naphthylamino)ethyl] ester Formula: C21H16N2O3 MolecularWeight: 344.36334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=CC=CC=C21)OC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C(=O)NC1=CC=CC2=CC=CC=C21)OC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H16N2O3/c1-14(26-21(25)17-11-9-15(13-22)10-12-17)20(24)23-19-8-4-6-16-5-2-3-7-18(16)19/h2-12,14H,1H3,(H,23,24)