3-[furan-2-yl-[2-[(1-phenylmethoxycarbonylpyrrolidin-2-yl)carbonylamino]ethanoyl]amino]-2-oxidanylidene-azetidine-1-sulfonic acid

Systemtic Name: 3-[furan-2-yl-[2-[(1-phenylmethoxycarbonylpyrrolidin-2-yl)carbonylamino]ethanoyl]amino]-2-oxidanylidene-azetidine-1-sulfonic acid Openeye Name: 3-[[2-[(1-benzyloxycarbonylpyrrolidine-2-carbonyl)amino]acetyl]-(2-furyl)amino]-2-oxo-azetidine-1-sulfonic acid CAS Name: 3-[2-furanyl-[1-oxo-2-[[oxo-(1-phenylmethoxycarbonyl-2-pyrrolidinyl)methyl]amino]ethyl]amino]-2-oxo-1-azetidinesulfonic acid IUPAC Name: 3-[furan-2-yl-[2-[(1-phenylmethoxycarbonylpyrrolidine-2-carbonyl)amino]acetyl]amino]-2-oxoazetidine-1-sulfonic acid Traditional Name: 3-[[2-[(1-carbobenzoxyprolyl)amino]acetyl]-(2-furyl)amino]-2-keto-azetidine-1-sulfonic acid Formula: C22H24N4O9S MolecularWeight: 520.51236

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NCC(=O)N(C3CN(C3=O)S(=O)(=O)O)C4=CC=CO4

Isomeric SMILES

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NCC(=O)N(C3CN(C3=O)S(=O)(=O)O)C4=CC=CO4

InChI

InChI=1S/C22H24N4O9S/c27-18(26(19-9-5-11-34-19)17-13-25(21(17)29)36(31,32)33)12-23-20(28)16-8-4-10-24(16)22(30)35-14-15-6-2-1-3-7-15/h1-3,5-7,9,11,16-17H,4,8,10,12-14H2,(H,23,28)(H,31,32,33)