2-[4-oxidanylidene-2-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]quinazolin-3-yl]ethanamide

Systemtic Name: 2-[4-oxidanylidene-2-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]quinazolin-3-yl]ethanamide Openeye Name: 2-[2-[(4-benzylpiperidin-1-ium-1-yl)methyl]-4-oxo-quinazolin-3-yl]acetamide CAS Name: 2-[4-oxo-2-[[4-(phenylmethyl)-1-piperidin-1-iumyl]methyl]-3-quinazolinyl]acetamide IUPAC Name: 2-[2-[(4-benzylpiperidin-1-ium-1-yl)methyl]-4-oxoquinazolin-3-yl]acetamide Traditional Name: 2-[2-[(4-benzylpiperidin-1-ium-1-yl)methyl]-4-keto-quinazolin-3-yl]acetamide Formula: C23H27N4O2+ MolecularWeight: 391.48608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=NC4=CC=CC=C4C(=O)N3CC(=O)N

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=NC4=CC=CC=C4C(=O)N3CC(=O)N

InChI

InChI=1S/C23H26N4O2/c24-21(28)15-27-22(25-20-9-5-4-8-19(20)23(27)29)16-26-12-10-18(11-13-26)14-17-6-2-1-3-7-17/h1-9,18H,10-16H2,(H2,24,28)/p+1