N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-4-thiophen-2-yl-butanamide

Systemtic Name: N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-4-thiophen-2-yl-butanamide Openeye Name: N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-4-(2-thienyl)butanamide CAS Name: N-[(1-methyl-4-piperidin-1-iumyl)methyl]-N-phenethyl-4-thiophen-2-ylbutanamide IUPAC Name: N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-4-thiophen-2-ylbutanamide Traditional Name: N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-4-(2-thienyl)butyramide Formula: C23H33N2OS+ MolecularWeight: 385.58592

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)CN(CCC2=CC=CC=C2)C(=O)CCCC3=CC=CS3

Isomeric SMILES

C[NH+]1CCC(CC1)CN(CCC2=CC=CC=C2)C(=O)CCCC3=CC=CS3

InChI

InChI=1S/C23H32N2OS/c1-24-15-12-21(13-16-24)19-25(17-14-20-7-3-2-4-8-20)23(26)11-5-9-22-10-6-18-27-22/h2-4,6-8,10,18,21H,5,9,11-17,19H2,1H3/p+1