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

Systemtic Name: 2-butyl-6-[(1-methyl-2-oxidanylidene-piperidin-3-yl)-oxidanyl-methyl]-1H-quinazolin-4-one Openeye Name: 2-butyl-6-[hydroxy-(1-methyl-2-oxo-3-piperidyl)methyl]-1H-quinazolin-4-one CAS Name: 2-butyl-6-[hydroxy-(1-methyl-2-oxo-3-piperidinyl)methyl]-1H-quinazolin-4-one IUPAC Name: 2-butyl-6-[hydroxy-(1-methyl-2-oxopiperidin-3-yl)methyl]-1H-quinazolin-4-one Traditional Name: 2-butyl-6-[hydroxy-(2-keto-1-methyl-3-piperidyl)methyl]-1H-quinazolin-4-one Formula: C19H25N3O3 MolecularWeight: 343.4201

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O3/c1-3-4-7-16-20-15-9-8-12(11-14(15)18(24)21-16)17(23)13-6-5-10-22(2)19(13)25/h8-9,11,13,17,23H,3-7,10H2,1-2H3,(H,20,21,24)