[2-(1-naphthalen-1-ylethylamino)-2-oxidanylidene-ethyl] 4-cyanobenzoate

Systemtic Name: [2-(1-naphthalen-1-ylethylamino)-2-oxidanylidene-ethyl] 4-cyanobenzoate Openeye Name: [2-[1-(1-naphthyl)ethylamino]-2-oxo-ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-[1-(1-naphthalenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-(1-naphthalen-1-ylethylamino)-2-oxoethyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-keto-2-[1-(1-naphthyl)ethylamino]ethyl] ester Formula: C22H18N2O3 MolecularWeight: 358.38992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)COC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)COC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H18N2O3/c1-15(19-8-4-6-17-5-2-3-7-20(17)19)24-21(25)14-27-22(26)18-11-9-16(13-23)10-12-18/h2-12,15H,14H2,1H3,(H,24,25)