7-chloranyl-2-[[4-[oxidanyl(phenyl)methyl]piperidin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[4-[oxidanyl(phenyl)methyl]piperidin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[4-[hydroxy(phenyl)methyl]-1-piperidyl]methyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[4-[hydroxy(phenyl)methyl]-1-piperidinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[4-[hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[4-[hydroxy(phenyl)methyl]piperidino]methyl]-1H-quinazolin-4-one Formula: C21H22ClN3O2 MolecularWeight: 383.87128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(C2=CC=CC=C2)O)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1C(C2=CC=CC=C2)O)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C21H22ClN3O2/c22-16-6-7-17-18(12-16)23-19(24-21(17)27)13-25-10-8-15(9-11-25)20(26)14-4-2-1-3-5-14/h1-7,12,15,20,26H,8-11,13H2,(H,23,24,27)