N-(2-butyl-3-propyl-quinolin-4-yl)-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-(2-butyl-3-propyl-quinolin-4-yl)-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-(2-butyl-3-propyl-4-quinolyl)-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-(2-butyl-3-propyl-4-quinolinyl)-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-(2-butyl-3-propylquinolin-4-yl)-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-(2-butyl-3-propyl-4-quinolyl)-2-piperidin-1-ium-1-yl-acetamide Formula: C23H34N3O+ MolecularWeight: 368.53556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2C(=C1CCC)NC(=O)C[NH+]3CCCCC3

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2C(=C1CCC)NC(=O)C[NH+]3CCCCC3

InChI

InChI=1S/C23H33N3O/c1-3-5-13-20-18(11-4-2)23(19-12-7-8-14-21(19)24-20)25-22(27)17-26-15-9-6-10-16-26/h7-8,12,14H,3-6,9-11,13,15-17H2,1-2H3,(H,24,25,27)/p+1