3-[1-[(6-chloranylquinolin-2-yl)methyl]piperidin-1-ium-4-yl]-N-(2-methoxyethyl)propanamide

Systemtic Name: 3-[1-[(6-chloranylquinolin-2-yl)methyl]piperidin-1-ium-4-yl]-N-(2-methoxyethyl)propanamide Openeye Name: 3-[1-[(6-chloro-2-quinolyl)methyl]piperidin-1-ium-4-yl]-N-(2-methoxyethyl)propanamide CAS Name: 3-[1-[(6-chloro-2-quinolinyl)methyl]-4-piperidin-1-iumyl]-N-(2-methoxyethyl)propanamide IUPAC Name: 3-[1-[(6-chloroquinolin-2-yl)methyl]piperidin-1-ium-4-yl]-N-(2-methoxyethyl)propanamide Traditional Name: 3-[1-[(6-chloro-2-quinolyl)methyl]piperidin-1-ium-4-yl]-N-(2-methoxyethyl)propionamide Formula: C21H29ClN3O2+ MolecularWeight: 390.92686

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)CCC1CC[NH+](CC1)CC2=NC3=C(C=C2)C=C(C=C3)Cl

Isomeric SMILES

COCCNC(=O)CCC1CC[NH+](CC1)CC2=NC3=C(C=C2)C=C(C=C3)Cl

InChI

InChI=1S/C21H28ClN3O2/c1-27-13-10-23-21(26)7-2-16-8-11-25(12-9-16)15-19-5-3-17-14-18(22)4-6-20(17)24-19/h3-6,14,16H,2,7-13,15H2,1H3,(H,23,26)/p+1