1-(phenylmethyl)-N-(thiophen-3-ylmethyl)piperidin-1-ium-4-amine

Systemtic Name: 1-(phenylmethyl)-N-(thiophen-3-ylmethyl)piperidin-1-ium-4-amine Openeye Name: 1-benzyl-N-(3-thienylmethyl)piperidin-1-ium-4-amine CAS Name: 1-(phenylmethyl)-N-(3-thiophenylmethyl)-4-piperidin-1-iumamine IUPAC Name: 1-benzyl-N-(thiophen-3-ylmethyl)piperidin-1-ium-4-amine Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-(3-thenyl)amine Formula: C17H23N2S+ MolecularWeight: 287.44292

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NCC2=CSC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1NCC2=CSC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C17H22N2S/c1-2-4-15(5-3-1)13-19-9-6-17(7-10-19)18-12-16-8-11-20-14-16/h1-5,8,11,14,17-18H,6-7,9-10,12-13H2/p+1