2-(1,2-benzoxazol-3-yl)-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]ethanamide

Systemtic Name: 2-(1,2-benzoxazol-3-yl)-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]ethanamide Openeye Name: 2-(1,2-benzoxazol-3-yl)-N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]acetamide CAS Name: 2-(1,2-benzoxazol-3-yl)-N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(1,2-benzoxazol-3-yl)-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]acetamide Traditional Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-indoxazen-3-yl-acetamide Formula: C19H22N3O3+ MolecularWeight: 340.39628

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)CC2=NOC3=CC=CC=C32)C4=CC=CO4

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)CC2=NOC3=CC=CC=C32)C4=CC=CO4

InChI

InChI=1S/C19H21N3O3/c23-19(12-15-14-6-1-2-7-17(14)25-21-15)20-13-16(18-8-5-11-24-18)22-9-3-4-10-22/h1-2,5-8,11,16H,3-4,9-10,12-13H2,(H,20,23)/p+1/t16-/m0/s1