2-(4-oxidanylidenequinazolin-3-yl)-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide

Systemtic Name: 2-(4-oxidanylidenequinazolin-3-yl)-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(4-oxoquinazolin-3-yl)acetamide CAS Name: 2-(4-oxo-3-quinazolinyl)-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]acetamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(4-oxoquinazolin-3-yl)acetamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(4-ketoquinazolin-3-yl)acetamide Formula: C22H25N4O2+ MolecularWeight: 377.4595

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)CN2C=NC3=CC=CC=C3C2=O)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)CN2C=NC3=CC=CC=C3C2=O)CC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O2/c27-21(15-26-16-23-20-9-5-4-8-19(20)22(26)28)24-18-10-12-25(13-11-18)14-17-6-2-1-3-7-17/h1-9,16,18H,10-15H2,(H,24,27)/p+1