[1-(4-chlorophenyl)-1-oxidanylidene-propan-2-yl] (E)-3-quinolin-2-ylprop-2-enoate

Systemtic Name: [1-(4-chlorophenyl)-1-oxidanylidene-propan-2-yl] (E)-3-quinolin-2-ylprop-2-enoate Openeye Name: [2-(4-chlorophenyl)-1-methyl-2-oxo-ethyl] (E)-3-(2-quinolyl)prop-2-enoate CAS Name: (E)-3-(2-quinolinyl)-2-propenoic acid [1-(4-chlorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-chlorophenyl)-1-oxopropan-2-yl] (E)-3-quinolin-2-ylprop-2-enoate Traditional Name: (E)-3-(2-quinolyl)acrylic acid [2-(4-chlorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C21H16ClNO3 MolecularWeight: 365.80964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)Cl)OC(=O)C=CC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)Cl)OC(=O)/C=C/C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H16ClNO3/c1-14(21(25)16-6-9-17(22)10-7-16)26-20(24)13-12-18-11-8-15-4-2-3-5-19(15)23-18/h2-14H,1H3/b13-12+