5-chloranyl-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]thiophene-2-carboxamide

Systemtic Name: 5-chloranyl-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]thiophene-2-carboxamide Openeye Name: 5-chloro-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]thiophene-2-carboxamide CAS Name: 5-chloro-N-[(3S)-1-(3-phenylpropyl)-3-piperidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: 5-chloro-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]thiophene-2-carboxamide Traditional Name: 5-chloro-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]thiophene-2-carboxamide Formula: C19H24ClN2OS+ MolecularWeight: 363.92466

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CCCC2=CC=CC=C2)NC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CCCC2=CC=CC=C2)NC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C19H23ClN2OS/c20-18-11-10-17(24-18)19(23)21-16-9-5-13-22(14-16)12-4-8-15-6-2-1-3-7-15/h1-3,6-7,10-11,16H,4-5,8-9,12-14H2,(H,21,23)/p+1/t16-/m0/s1