N-[4-[[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]phenyl]furan-2-carboxamide Openeye Name: N-[4-[[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]phenyl]furan-2-carboxamide CAS Name: N-[4-[[[(2R)-2-(4-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]amino]-oxomethyl]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]carbamoyl]phenyl]furan-2-carboxamide Traditional Name: N-[4-[[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]phenyl]-2-furamide Formula: C25H28N3O4+ MolecularWeight: 434.50752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CO3)[NH+]4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CO3)[NH+]4CCCC4

InChI

InChI=1S/C25H27N3O4/c1-31-21-12-8-18(9-13-21)22(28-14-2-3-15-28)17-26-24(29)19-6-10-20(11-7-19)27-25(30)23-5-4-16-32-23/h4-13,16,22H,2-3,14-15,17H2,1H3,(H,26,29)(H,27,30)/p+1/t22-/m0/s1