N-(4-acetamidophenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide

Systemtic Name: N-(4-acetamidophenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide Openeye Name: N-(4-acetamidophenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide CAS Name: N-(4-acetamidophenyl)-5-(1-pyrrolidin-1-iumylmethyl)-2-furancarboxamide IUPAC Name: N-(4-acetamidophenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide Traditional Name: N-(4-acetamidophenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)-2-furamide Formula: C18H22N3O3+ MolecularWeight: 328.38558

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC=C(O2)C[NH+]3CCCC3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC=C(O2)C[NH+]3CCCC3

InChI

InChI=1S/C18H21N3O3/c1-13(22)19-14-4-6-15(7-5-14)20-18(23)17-9-8-16(24-17)12-21-10-2-3-11-21/h4-9H,2-3,10-12H2,1H3,(H,19,22)(H,20,23)/p+1