2-(azepan-1-ium-1-yl)-N-(2-ethyl-3-methyl-quinolin-4-yl)ethanamide

Systemtic Name: 2-(azepan-1-ium-1-yl)-N-(2-ethyl-3-methyl-quinolin-4-yl)ethanamide Openeye Name: 2-(azepan-1-ium-1-yl)-N-(2-ethyl-3-methyl-4-quinolyl)acetamide CAS Name: 2-(1-azepan-1-iumyl)-N-(2-ethyl-3-methyl-4-quinolinyl)acetamide IUPAC Name: 2-(azepan-1-ium-1-yl)-N-(2-ethyl-3-methylquinolin-4-yl)acetamide Traditional Name: 2-(azepan-1-ium-1-yl)-N-(2-ethyl-3-methyl-4-quinolyl)acetamide Formula: C20H28N3O+ MolecularWeight: 326.45582

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)NC(=O)C[NH+]3CCCCCC3

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)NC(=O)C[NH+]3CCCCCC3

InChI

InChI=1S/C20H27N3O/c1-3-17-15(2)20(16-10-6-7-11-18(16)21-17)22-19(24)14-23-12-8-4-5-9-13-23/h6-7,10-11H,3-5,8-9,12-14H2,1-2H3,(H,21,22,24)/p+1