2-[4-(1,3-benzoxazol-2-yl)piperidin-1-ium-1-yl]-N-quinolin-5-yl-ethanamide

Systemtic Name: 2-[4-(1,3-benzoxazol-2-yl)piperidin-1-ium-1-yl]-N-quinolin-5-yl-ethanamide Openeye Name: 2-[4-(1,3-benzoxazol-2-yl)piperidin-1-ium-1-yl]-N-(5-quinolyl)acetamide CAS Name: 2-[4-(1,3-benzoxazol-2-yl)-1-piperidin-1-iumyl]-N-(5-quinolinyl)acetamide IUPAC Name: 2-[4-(1,3-benzoxazol-2-yl)piperidin-1-ium-1-yl]-N-quinolin-5-ylacetamide Traditional Name: 2-[4-(1,3-benzoxazol-2-yl)piperidin-1-ium-1-yl]-N-(5-quinolyl)acetamide Formula: C23H23N4O2+ MolecularWeight: 387.45432

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=NC3=CC=CC=C3O2)CC(=O)NC4=CC=CC5=C4C=CC=N5

Isomeric SMILES

C1C[NH+](CCC1C2=NC3=CC=CC=C3O2)CC(=O)NC4=CC=CC5=C4C=CC=N5

InChI

InChI=1S/C23H22N4O2/c28-22(25-19-8-3-7-18-17(19)5-4-12-24-18)15-27-13-10-16(11-14-27)23-26-20-6-1-2-9-21(20)29-23/h1-9,12,16H,10-11,13-15H2,(H,25,28)/p+1