[1-(phenylmethyl)piperidin-1-ium-4-yl]-[2-(thiophen-2-ylcarbonylamino)ethyl]azanium

Systemtic Name: [1-(phenylmethyl)piperidin-1-ium-4-yl]-[2-(thiophen-2-ylcarbonylamino)ethyl]azanium Openeye Name: (1-benzylpiperidin-1-ium-4-yl)-[2-(thiophene-2-carbonylamino)ethyl]ammonium CAS Name: 2-[[oxo(thiophen-2-yl)methyl]amino]ethyl-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (1-benzylpiperidin-1-ium-4-yl)-[2-(thiophene-2-carbonylamino)ethyl]azanium Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-[2-(2-thenoylamino)ethyl]ammonium Formula: C19H27N3OS+2 MolecularWeight: 345.50218

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH2+]CCNC(=O)C2=CC=CS2)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1[NH2+]CCNC(=O)C2=CC=CS2)CC3=CC=CC=C3

InChI

InChI=1S/C19H25N3OS/c23-19(18-7-4-14-24-18)21-11-10-20-17-8-12-22(13-9-17)15-16-5-2-1-3-6-16/h1-7,14,17,20H,8-13,15H2,(H,21,23)/p+2