5-chloranyl-3-[(1-methyl-4-oxidanyl-piperidin-1-ium-4-yl)methyl]quinazolin-4-one

Systemtic Name: 5-chloranyl-3-[(1-methyl-4-oxidanyl-piperidin-1-ium-4-yl)methyl]quinazolin-4-one Openeye Name: 5-chloro-3-[(4-hydroxy-1-methyl-piperidin-1-ium-4-yl)methyl]quinazolin-4-one CAS Name: 5-chloro-3-[(4-hydroxy-1-methyl-4-piperidin-1-iumyl)methyl]-4-quinazolinone IUPAC Name: 5-chloro-3-[(4-hydroxy-1-methylpiperidin-1-ium-4-yl)methyl]quinazolin-4-one Traditional Name: 5-chloro-3-[(4-hydroxy-1-methyl-piperidin-1-ium-4-yl)methyl]quinazolin-4-one Formula: C15H19ClN3O2+ MolecularWeight: 308.78326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)(CN2C=NC3=C(C2=O)C(=CC=C3)Cl)O

Isomeric SMILES

C[NH+]1CCC(CC1)(CN2C=NC3=C(C2=O)C(=CC=C3)Cl)O

InChI

InChI=1S/C15H18ClN3O2/c1-18-7-5-15(21,6-8-18)9-19-10-17-12-4-2-3-11(16)13(12)14(19)20/h2-4,10,21H,5-9H2,1H3/p+1