N-[(3S)-1-ethylpiperidin-1-ium-3-yl]-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxamide

Systemtic Name: N-[(3S)-1-ethylpiperidin-1-ium-3-yl]-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxamide Openeye Name: N-[(3S)-1-ethylpiperidin-1-ium-3-yl]-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxamide CAS Name: N-[(3S)-1-ethyl-3-piperidin-1-iumyl]-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxamide IUPAC Name: N-[(3S)-1-ethylpiperidin-1-ium-3-yl]-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxamide Traditional Name: N-[(3S)-1-ethylpiperidin-1-ium-3-yl]-4,5,6,7-tetrahydroisobenzothiophene-1-carboxamide Formula: C16H25N2OS+ MolecularWeight: 293.4475

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC(C1)NC(=O)C2=C3CCCCC3=CS2

Isomeric SMILES

CC[NH+]1CCC[C@@H](C1)NC(=O)C2=C3CCCCC3=CS2

InChI

InChI=1S/C16H24N2OS/c1-2-18-9-5-7-13(10-18)17-16(19)15-14-8-4-3-6-12(14)11-20-15/h11,13H,2-10H2,1H3,(H,17,19)/p+1/t13-/m0/s1