N-(3-chloranyl-4-methoxy-phenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-5-(1-pyrrolidin-1-iumylmethyl)-2-furancarboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)-2-furamide Formula: C17H20ClN2O3+ MolecularWeight: 335.8053

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC=C(O2)C[NH+]3CCCC3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC=C(O2)C[NH+]3CCCC3)Cl

InChI

InChI=1S/C17H19ClN2O3/c1-22-15-6-4-12(10-14(15)18)19-17(21)16-7-5-13(23-16)11-20-8-2-3-9-20/h4-7,10H,2-3,8-9,11H2,1H3,(H,19,21)/p+1