2-(2,3-dihydro-1,4-benzoxazin-4-yl)-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzoxazin-4-yl)-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(2,3-dihydro-1,4-benzoxazin-4-yl)acetamide CAS Name: 2-(2,3-dihydro-1,4-benzoxazin-4-yl)-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]acetamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(2,3-dihydro-1,4-benzoxazin-4-yl)acetamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(2,3-dihydro-1,4-benzoxazin-4-yl)acetamide Formula: C22H28N3O2+ MolecularWeight: 366.47662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)CN2CCOC3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)CN2CCOC3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C22H27N3O2/c26-22(17-25-14-15-27-21-9-5-4-8-20(21)25)23-19-10-12-24(13-11-19)16-18-6-2-1-3-7-18/h1-9,19H,10-17H2,(H,23,26)/p+1