N-(2-methoxy-5-methyl-phenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide CAS Name: N-(2-methoxy-5-methylphenyl)-5-(1-pyrrolidin-1-iumylmethyl)-2-furancarboxamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide Traditional Name: N-(2-methoxy-5-methyl-phenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)-2-furamide Formula: C18H23N2O3+ MolecularWeight: 315.38682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C2=CC=C(O2)C[NH+]3CCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C2=CC=C(O2)C[NH+]3CCCC3

InChI

InChI=1S/C18H22N2O3/c1-13-5-7-16(22-2)15(11-13)19-18(21)17-8-6-14(23-17)12-20-9-3-4-10-20/h5-8,11H,3-4,9-10,12H2,1-2H3,(H,19,21)/p+1