5-ethanoyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]thiophene-2-carboxamide

Systemtic Name: 5-ethanoyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]thiophene-2-carboxamide Openeye Name: 5-acetyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]thiophene-2-carboxamide CAS Name: 5-acetyl-N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-2-thiophenecarboxamide IUPAC Name: 5-acetyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]thiophene-2-carboxamide Traditional Name: 5-acetyl-N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]thiophene-2-carboxamide Formula: C19H23N2O2S+ MolecularWeight: 343.46312

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)C(=O)NCC2=CC=CC=C2C[NH+]3CCCC3

Isomeric SMILES

CC(=O)C1=CC=C(S1)C(=O)NCC2=CC=CC=C2C[NH+]3CCCC3

InChI

InChI=1S/C19H22N2O2S/c1-14(22)17-8-9-18(24-17)19(23)20-12-15-6-2-3-7-16(15)13-21-10-4-5-11-21/h2-3,6-9H,4-5,10-13H2,1H3,(H,20,23)/p+1