6,8-bis(bromanyl)-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-1H-quinazolin-4-one

Systemtic Name: 6,8-bis(bromanyl)-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-1H-quinazolin-4-one Openeye Name: 6,8-dibromo-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-1H-quinazolin-4-one CAS Name: 6,8-dibromo-2-[(4-methyl-1-piperidin-1-iumyl)methyl]-1H-quinazolin-4-one IUPAC Name: 6,8-dibromo-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-1H-quinazolin-4-one Traditional Name: 6,8-dibromo-2-[(4-methylpiperidin-1-ium-1-yl)methyl]-1H-quinazolin-4-one Formula: C15H18Br2N3O+ MolecularWeight: 416.13092

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=NC(=O)C3=CC(=CC(=C3N2)Br)Br

Isomeric SMILES

CC1CC[NH+](CC1)CC2=NC(=O)C3=CC(=CC(=C3N2)Br)Br

InChI

InChI=1S/C15H17Br2N3O/c1-9-2-4-20(5-3-9)8-13-18-14-11(15(21)19-13)6-10(16)7-12(14)17/h6-7,9H,2-5,8H2,1H3,(H,18,19,21)/p+1