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

Systemtic Name: N-ethyl-1-[(3-methylthiophen-2-yl)methyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-benzyl-N-ethyl-1-[(3-methyl-2-thienyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-ethyl-1-[(3-methyl-2-thiophenyl)methyl]-N-(phenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-benzyl-N-ethyl-1-[(3-methylthiophen-2-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-benzyl-N-ethyl-1-[(3-methyl-2-thienyl)methyl]piperidin-1-ium-4-carboxamide Formula: C21H29N2OS+ MolecularWeight: 357.53276

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)C2CC[NH+](CC2)CC3=C(C=CS3)C

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)C2CC[NH+](CC2)CC3=C(C=CS3)C

InChI

InChI=1S/C21H28N2OS/c1-3-23(15-18-7-5-4-6-8-18)21(24)19-9-12-22(13-10-19)16-20-17(2)11-14-25-20/h4-8,11,14,19H,3,9-10,12-13,15-16H2,1-2H3/p+1