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

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-(2-hydroxyethyl)-4-oxidanylidene-6-(3-oxidanylpropyl)quinoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-1-(2-hydroxyethyl)-6-(3-hydroxypropyl)-4-oxo-quinoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-1-(2-hydroxyethyl)-6-(3-hydroxypropyl)-4-oxo-3-quinolinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-1-(2-hydroxyethyl)-6-(3-hydroxypropyl)-4-oxoquinoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-1-(2-hydroxyethyl)-6-(3-hydroxypropyl)-4-keto-quinoline-3-carboxamide Formula: C22H23ClN2O4 MolecularWeight: 414.88202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CN(C3=C(C2=O)C=C(C=C3)CCCO)CCO)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CN(C3=C(C2=O)C=C(C=C3)CCCO)CCO)Cl

InChI

InChI=1S/C22H23ClN2O4/c23-17-6-3-16(4-7-17)13-24-22(29)19-14-25(9-11-27)20-8-5-15(2-1-10-26)12-18(20)21(19)28/h3-8,12,14,26-27H,1-2,9-11,13H2,(H,24,29)