N-[(4-methoxyphenyl)methyl]-1-(thiophen-2-ylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-[(4-methoxyphenyl)methyl]-1-(thiophen-2-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-[(4-methoxyphenyl)methyl]-1-(2-thienylmethyl)piperidin-1-ium-4-carboxamide CAS Name: N-[(4-methoxyphenyl)methyl]-1-(thiophen-2-ylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-1-(thiophen-2-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: N-p-anisyl-1-(2-thenyl)piperidin-1-ium-4-carboxamide Formula: C19H25N2O2S+ MolecularWeight: 345.479

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2CC[NH+](CC2)CC3=CC=CS3

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2CC[NH+](CC2)CC3=CC=CS3

InChI

InChI=1S/C19H24N2O2S/c1-23-17-6-4-15(5-7-17)13-20-19(22)16-8-10-21(11-9-16)14-18-3-2-12-24-18/h2-7,12,16H,8-11,13-14H2,1H3,(H,20,22)/p+1