6-tert-butyl-3-[[[4-(3-oxidanylpiperidin-1-yl)phenyl]amino]methyl]-1H-quinolin-2-one

Systemtic Name: 6-tert-butyl-3-[[[4-(3-oxidanylpiperidin-1-yl)phenyl]amino]methyl]-1H-quinolin-2-one Openeye Name: 6-tert-butyl-3-[[4-(3-hydroxy-1-piperidyl)anilino]methyl]-1H-quinolin-2-one CAS Name: 6-tert-butyl-3-[[4-(3-hydroxy-1-piperidinyl)anilino]methyl]-1H-quinolin-2-one IUPAC Name: 6-tert-butyl-3-[[4-(3-hydroxypiperidin-1-yl)anilino]methyl]-1H-quinolin-2-one Traditional Name: 6-tert-butyl-3-[[4-(3-hydroxypiperidino)anilino]methyl]carbostyril Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)NC(=O)C(=C2)CNC3=CC=C(C=C3)N4CCCC(C4)O

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)NC(=O)C(=C2)CNC3=CC=C(C=C3)N4CCCC(C4)O

InChI

InChI=1S/C25H31N3O2/c1-25(2,3)19-6-11-23-17(14-19)13-18(24(30)27-23)15-26-20-7-9-21(10-8-20)28-12-4-5-22(29)16-28/h6-11,13-14,22,26,29H,4-5,12,15-16H2,1-3H3,(H,27,30)