3-[3-(4-oxidanylpiperidin-1-ium-1-yl)propyl]quinazolin-4-one

Systemtic Name: 3-[3-(4-oxidanylpiperidin-1-ium-1-yl)propyl]quinazolin-4-one Openeye Name: 3-[3-(4-hydroxypiperidin-1-ium-1-yl)propyl]quinazolin-4-one CAS Name: 3-[3-(4-hydroxy-1-piperidin-1-iumyl)propyl]-4-quinazolinone IUPAC Name: 3-[3-(4-hydroxypiperidin-1-ium-1-yl)propyl]quinazolin-4-one Traditional Name: 3-[3-(4-hydroxypiperidin-1-ium-1-yl)propyl]quinazolin-4-one Formula: C16H22N3O2+ MolecularWeight: 288.36478

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1O)CCCN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

C1C[NH+](CCC1O)CCCN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C16H21N3O2/c20-13-6-10-18(11-7-13)8-3-9-19-12-17-15-5-2-1-4-14(15)16(19)21/h1-2,4-5,12-13,20H,3,6-11H2/p+1