1-[(3-methylthiophen-2-yl)methyl]-N-phenethyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3-methylthiophen-2-yl)methyl]-N-phenethyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[(3-methyl-2-thienyl)methyl]-N-phenethyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(3-methyl-2-thiophenyl)methyl]-N-phenethyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(3-methylthiophen-2-yl)methyl]-N-phenethylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[(3-methyl-2-thienyl)methyl]-N-phenethyl-piperidin-1-ium-4-carboxamide Formula: C20H27N2OS+ MolecularWeight: 343.50618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C[NH+]2CCC(CC2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(SC=C1)C[NH+]2CCC(CC2)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C20H26N2OS/c1-16-10-14-24-19(16)15-22-12-8-18(9-13-22)20(23)21-11-7-17-5-3-2-4-6-17/h2-6,10,14,18H,7-9,11-13,15H2,1H3,(H,21,23)/p+1