ethyl 6-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 6-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 6-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]-4-oxo-1H-quinoline-3-carboxylate CAS Name: 6-[[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]amino]-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 6-[[(E)-3-(4-chlorophenyl)acryloyl]amino]-4-keto-1H-quinoline-3-carboxylic acid ethyl ester Formula: C21H17ClN2O4 MolecularWeight: 396.82368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=C(C1=O)C=C(C=C2)NC(=O)C=CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CNC2=C(C1=O)C=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H17ClN2O4/c1-2-28-21(27)17-12-23-18-9-8-15(11-16(18)20(17)26)24-19(25)10-5-13-3-6-14(22)7-4-13/h3-12H,2H2,1H3,(H,23,26)(H,24,25)/b10-5+