4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]butanamide

Systemtic Name: 4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]butanamide Openeye Name: 4-(8-methyl-4-oxo-quinazolin-3-yl)-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]butanamide CAS Name: 4-(8-methyl-4-oxo-3-quinazolinyl)-N-[[4-[(4-methyl-1-piperidin-1-iumyl)methyl]phenyl]methyl]butanamide IUPAC Name: 4-(8-methyl-4-oxoquinazolin-3-yl)-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]butanamide Traditional Name: 4-(4-keto-8-methyl-quinazolin-3-yl)-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]benzyl]butyramide Formula: C27H35N4O2+ MolecularWeight: 447.5924

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)CCCN3C=NC4=C(C3=O)C=CC=C4C

Isomeric SMILES

CC1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)CCCN3C=NC4=C(C3=O)C=CC=C4C

InChI

InChI=1S/C27H34N4O2/c1-20-12-15-30(16-13-20)18-23-10-8-22(9-11-23)17-28-25(32)7-4-14-31-19-29-26-21(2)5-3-6-24(26)27(31)33/h3,5-6,8-11,19-20H,4,7,12-18H2,1-2H3,(H,28,32)/p+1