2-oxidanylidene-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]-1H-quinoline-3-carboxamide

Systemtic Name: 2-oxidanylidene-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]-1H-quinoline-3-carboxamide Openeye Name: 2-oxo-N-[[4-(1-piperidylsulfonyl)phenyl]methyl]-1H-quinoline-3-carboxamide CAS Name: 2-oxo-N-[[4-(1-piperidinylsulfonyl)phenyl]methyl]-1H-quinoline-3-carboxamide IUPAC Name: 2-oxo-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]-1H-quinoline-3-carboxamide Traditional Name: 2-keto-N-(4-piperidinosulfonylbenzyl)-1H-quinoline-3-carboxamide Formula: C22H23N3O4S MolecularWeight: 425.50072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CNC(=O)C3=CC4=CC=CC=C4NC3=O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CNC(=O)C3=CC4=CC=CC=C4NC3=O

InChI

InChI=1S/C22H23N3O4S/c26-21(19-14-17-6-2-3-7-20(17)24-22(19)27)23-15-16-8-10-18(11-9-16)30(28,29)25-12-4-1-5-13-25/h2-3,6-11,14H,1,4-5,12-13,15H2,(H,23,26)(H,24,27)