3-chloranyl-N-[2-oxidanylidene-2-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-oxidanylidene-2-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]ethyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]-2-oxo-ethyl]-3-chloro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-oxo-2-[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]-2-oxoethyl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]-2-keto-ethyl]-3-chloro-benzothiophene-2-carboxamide Formula: C23H25ClN3O2S+ MolecularWeight: 442.9815

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C23H24ClN3O2S/c24-21-18-8-4-5-9-19(18)30-22(21)23(29)25-14-20(28)26-17-10-12-27(13-11-17)15-16-6-2-1-3-7-16/h1-9,17H,10-15H2,(H,25,29)(H,26,28)/p+1