5-chloranyl-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1-benzofuran-2-carboxamide

Systemtic Name: 5-chloranyl-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1-benzofuran-2-carboxamide Openeye Name: 5-chloro-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzofuran-2-carboxamide CAS Name: 5-chloro-N-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-2-benzofurancarboxamide IUPAC Name: 5-chloro-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1-benzofuran-2-carboxamide Traditional Name: 5-chloro-N-[4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]coumarilamide Formula: C21H22ClN2O2+ MolecularWeight: 369.86458

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)C3=CC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)C3=CC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C21H21ClN2O2/c22-18-7-8-19-17(11-18)12-20(26-19)21(25)23-13-15-3-5-16(6-4-15)14-24-9-1-2-10-24/h3-8,11-12H,1-2,9-10,13-14H2,(H,23,25)/p+1