N-(2-methyl-2-piperidin-1-ium-1-yl-propyl)-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methoxy]ethanamide

Systemtic Name: N-(2-methyl-2-piperidin-1-ium-1-yl-propyl)-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methoxy]ethanamide Openeye Name: N-(2-methyl-2-piperidin-1-ium-1-yl-propyl)-2-[(4-oxo-1H-quinazolin-2-yl)methoxy]acetamide CAS Name: N-[2-methyl-2-(1-piperidin-1-iumyl)propyl]-2-[(4-oxo-1H-quinazolin-2-yl)methoxy]acetamide IUPAC Name: N-(2-methyl-2-piperidin-1-ium-1-ylpropyl)-2-[(4-oxo-1H-quinazolin-2-yl)methoxy]acetamide Traditional Name: 2-[(4-keto-1H-quinazolin-2-yl)methoxy]-N-(2-methyl-2-piperidin-1-ium-1-yl-propyl)acetamide Formula: C20H29N4O3+ MolecularWeight: 373.46926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)COCC1=NC(=O)C2=CC=CC=C2N1)[NH+]3CCCCC3

Isomeric SMILES

CC(C)(CNC(=O)COCC1=NC(=O)C2=CC=CC=C2N1)[NH+]3CCCCC3

InChI

InChI=1S/C20H28N4O3/c1-20(2,24-10-6-3-7-11-24)14-21-18(25)13-27-12-17-22-16-9-5-4-8-15(16)19(26)23-17/h4-5,8-9H,3,6-7,10-14H2,1-2H3,(H,21,25)(H,22,23,26)/p+1