2-butyl-6-[1-(1-methyl-2-oxidanylidene-piperidin-3-yl)-1-oxidanyl-ethyl]-1H-quinazolin-4-one

Systemtic Name: 2-butyl-6-[1-(1-methyl-2-oxidanylidene-piperidin-3-yl)-1-oxidanyl-ethyl]-1H-quinazolin-4-one Openeye Name: 2-butyl-6-[1-hydroxy-1-(1-methyl-2-oxo-3-piperidyl)ethyl]-1H-quinazolin-4-one CAS Name: 2-butyl-6-[1-hydroxy-1-(1-methyl-2-oxo-3-piperidinyl)ethyl]-1H-quinazolin-4-one IUPAC Name: 2-butyl-6-[1-hydroxy-1-(1-methyl-2-oxopiperidin-3-yl)ethyl]-1H-quinazolin-4-one Traditional Name: 2-butyl-6-[1-hydroxy-1-(2-keto-1-methyl-3-piperidyl)ethyl]-1H-quinazolin-4-one Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=O)C2=C(N1)C=CC(=C2)C(C)(C3CCCN(C3=O)C)O

Isomeric SMILES

CCCCC1=NC(=O)C2=C(N1)C=CC(=C2)C(C)(C3CCCN(C3=O)C)O

InChI

InChI=1S/C20H27N3O3/c1-4-5-8-17-21-16-10-9-13(12-14(16)18(24)22-17)20(2,26)15-7-6-11-23(3)19(15)25/h9-10,12,15,26H,4-8,11H2,1-3H3,(H,21,22,24)