N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-pyrrol-1-yl-benzamide

Systemtic Name: N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-pyrrol-1-yl-benzamide Openeye Name: N-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-pyrrol-1-yl-benzamide CAS Name: N-[(2R)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-(1-pyrrolyl)benzamide IUPAC Name: N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]-4-pyrrol-1-ylbenzamide Traditional Name: N-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-pyrrol-1-yl-benzamide Formula: C21H24N3O2+ MolecularWeight: 350.43416

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)C2=CC=C(C=C2)N3C=CC=C3)C4=CC=CO4

Isomeric SMILES

C1CC[NH+](C1)[C@H](CNC(=O)C2=CC=C(C=C2)N3C=CC=C3)C4=CC=CO4

InChI

InChI=1S/C21H23N3O2/c25-21(17-7-9-18(10-8-17)23-11-1-2-12-23)22-16-19(20-6-5-15-26-20)24-13-3-4-14-24/h1-2,5-12,15,19H,3-4,13-14,16H2,(H,22,25)/p+1/t19-/m1/s1