6-bromanyl-3-(4-chlorophenyl)-N-[3-(3-methylpiperidin-1-ium-1-yl)propyl]-4-oxidanyl-2-oxidanylidene-1H-quinazoline-4-carboxamide

Systemtic Name: 6-bromanyl-3-(4-chlorophenyl)-N-[3-(3-methylpiperidin-1-ium-1-yl)propyl]-4-oxidanyl-2-oxidanylidene-1H-quinazoline-4-carboxamide Openeye Name: 6-bromo-3-(4-chlorophenyl)-4-hydroxy-N-[3-(3-methylpiperidin-1-ium-1-yl)propyl]-2-oxo-1H-quinazoline-4-carboxamide CAS Name: 6-bromo-3-(4-chlorophenyl)-4-hydroxy-N-[3-(3-methyl-1-piperidin-1-iumyl)propyl]-2-oxo-1H-quinazoline-4-carboxamide IUPAC Name: 6-bromo-3-(4-chlorophenyl)-4-hydroxy-N-[3-(3-methylpiperidin-1-ium-1-yl)propyl]-2-oxo-1H-quinazoline-4-carboxamide Traditional Name: 6-bromo-3-(4-chlorophenyl)-4-hydroxy-2-keto-N-[3-(3-methylpiperidin-1-ium-1-yl)propyl]-1H-quinazoline-4-carboxamide Formula: C24H29BrClN4O3+ MolecularWeight: 536.86906

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCCNC(=O)C2(C3=C(C=CC(=C3)Br)NC(=O)N2C4=CC=C(C=C4)Cl)O

Isomeric SMILES

CC1CCC[NH+](C1)CCCNC(=O)C2(C3=C(C=CC(=C3)Br)NC(=O)N2C4=CC=C(C=C4)Cl)O

InChI

InChI=1S/C24H28BrClN4O3/c1-16-4-2-12-29(15-16)13-3-11-27-22(31)24(33)20-14-17(25)5-10-21(20)28-23(32)30(24)19-8-6-18(26)7-9-19/h5-10,14,16,33H,2-4,11-13,15H2,1H3,(H,27,31)(H,28,32)/p+1