N-[(4-chlorophenyl)methyl]-1-methyl-5-oxidanyl-2-oxidanylidene-3-(3-oxidanylpropyl)quinoline-6-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-methyl-5-oxidanyl-2-oxidanylidene-3-(3-oxidanylpropyl)quinoline-6-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-5-hydroxy-3-(3-hydroxypropyl)-1-methyl-2-oxo-quinoline-6-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-5-hydroxy-3-(3-hydroxypropyl)-1-methyl-2-oxo-6-quinolinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-5-hydroxy-3-(3-hydroxypropyl)-1-methyl-2-oxoquinoline-6-carboxamide Traditional Name: N-(4-chlorobenzyl)-5-hydroxy-3-(3-hydroxypropyl)-2-keto-1-methyl-quinoline-6-carboxamide Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C1=O)CCCO)C(=C(C=C2)C(=O)NCC3=CC=C(C=C3)Cl)O

Isomeric SMILES

CN1C2=C(C=C(C1=O)CCCO)C(=C(C=C2)C(=O)NCC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C21H21ClN2O4/c1-24-18-9-8-16(20(27)23-12-13-4-6-15(22)7-5-13)19(26)17(18)11-14(21(24)28)3-2-10-25/h4-9,11,25-26H,2-3,10,12H2,1H3,(H,23,27)