N-[(4-chlorophenyl)methyl]-1-methyl-4-oxidanylidene-8-(3-oxidanylprop-1-ynyl)quinoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-methyl-4-oxidanylidene-8-(3-oxidanylprop-1-ynyl)quinoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-8-(3-hydroxyprop-1-ynyl)-1-methyl-4-oxo-quinoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-8-(3-hydroxyprop-1-ynyl)-1-methyl-4-oxo-3-quinolinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-8-(3-hydroxyprop-1-ynyl)-1-methyl-4-oxoquinoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-8-(3-hydroxyprop-1-ynyl)-4-keto-1-methyl-quinoline-3-carboxamide Formula: C21H17ClN2O3 MolecularWeight: 380.82428

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=CC=CC(=C21)C#CCO)C(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C=C(C(=O)C2=CC=CC(=C21)C#CCO)C(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H17ClN2O3/c1-24-13-18(21(27)23-12-14-7-9-16(22)10-8-14)20(26)17-6-2-4-15(19(17)24)5-3-11-25/h2,4,6-10,13,25H,11-12H2,1H3,(H,23,27)