(2S)-1-(furan-2-ylcarbonyl)-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-(furan-2-ylcarbonyl)-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-1-[2-furanyl(oxo)methyl]-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-1-(2-furoyl)pyrrolidine-2-carboxamide Formula: C21H26N3O3+ MolecularWeight: 368.44944

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=CO2)C(=O)NC3CC[NH+](C3)CC4=CC=CC=C4

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CC=CO2)C(=O)N[C@H]3CC[NH+](C3)CC4=CC=CC=C4

InChI

InChI=1S/C21H25N3O3/c25-20(18-8-4-11-24(18)21(26)19-9-5-13-27-19)22-17-10-12-23(15-17)14-16-6-2-1-3-7-16/h1-3,5-7,9,13,17-18H,4,8,10-12,14-15H2,(H,22,25)/p+1/t17-,18-/m0/s1