2-(8-chloranylnaphthalen-1-yl)sulfanyl-N-(1-propylpiperidin-1-ium-4-yl)ethanamide

Systemtic Name: 2-(8-chloranylnaphthalen-1-yl)sulfanyl-N-(1-propylpiperidin-1-ium-4-yl)ethanamide Openeye Name: 2-[(8-chloro-1-naphthyl)sulfanyl]-N-(1-propylpiperidin-1-ium-4-yl)acetamide CAS Name: 2-[(8-chloro-1-naphthalenyl)thio]-N-(1-propyl-4-piperidin-1-iumyl)acetamide IUPAC Name: 2-(8-chloronaphthalen-1-yl)sulfanyl-N-(1-propylpiperidin-1-ium-4-yl)acetamide Traditional Name: 2-[(8-chloro-1-naphthyl)thio]-N-(1-propylpiperidin-1-ium-4-yl)acetamide Formula: C20H26ClN2OS+ MolecularWeight: 377.95124

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=O)CSC2=CC=CC3=C2C(=CC=C3)Cl

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=O)CSC2=CC=CC3=C2C(=CC=C3)Cl

InChI

InChI=1S/C20H25ClN2OS/c1-2-11-23-12-9-16(10-13-23)22-19(24)14-25-18-8-4-6-15-5-3-7-17(21)20(15)18/h3-8,16H,2,9-14H2,1H3,(H,22,24)/p+1