4-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]butanamide

Systemtic Name: 4-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]butanamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-4-(2,4-dioxo-1H-quinazolin-3-yl)butanamide CAS Name: 4-(2,4-dioxo-1H-quinazolin-3-yl)-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]butanamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-4-(2,4-dioxo-1H-quinazolin-3-yl)butanamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-4-(2,4-diketo-1H-quinazolin-3-yl)butyramide Formula: C24H29N4O3+ MolecularWeight: 421.51206

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)CCCN2C(=O)C3=CC=CC=C3NC2=O)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)CCCN2C(=O)C3=CC=CC=C3NC2=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H28N4O3/c29-22(25-19-12-15-27(16-13-19)17-18-7-2-1-3-8-18)11-6-14-28-23(30)20-9-4-5-10-21(20)26-24(28)31/h1-5,7-10,19H,6,11-17H2,(H,25,29)(H,26,31)/p+1