3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]propanamide

Systemtic Name: 3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]propanamide Openeye Name: 3-(3-methyl-4-oxo-quinazolin-2-yl)-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]propanamide CAS Name: 3-(3-methyl-4-oxo-2-quinazolinyl)-N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]propanamide IUPAC Name: 3-(3-methyl-4-oxoquinazolin-2-yl)-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]propanamide Traditional Name: 3-(4-keto-3-methyl-quinazolin-2-yl)-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]propionamide Formula: C24H35N4O2+ MolecularWeight: 411.5603

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=CC=CC=C2C1=O)CCC(=O)NCC3(CCCCC3)[NH+]4CCCCC4

Isomeric SMILES

CN1C(=NC2=CC=CC=C2C1=O)CCC(=O)NCC3(CCCCC3)[NH+]4CCCCC4

InChI

InChI=1S/C24H34N4O2/c1-27-21(26-20-11-5-4-10-19(20)23(27)30)12-13-22(29)25-18-24(14-6-2-7-15-24)28-16-8-3-9-17-28/h4-5,10-11H,2-3,6-9,12-18H2,1H3,(H,25,29)/p+1