1-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid

Systemtic Name: 1-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid Openeye Name: 1-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methyl]-5-oxo-pyrrolidine-3-carboxylic acid CAS Name: 1-[[5-(1,3-benzothiazol-2-yl)-2-furanyl]methyl]-5-oxo-3-pyrrolidinecarboxylic acid IUPAC Name: 1-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-5-oxopyrrolidine-3-carboxylic acid Traditional Name: 1-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methyl]-5-keto-pyrrolidine-3-carboxylic acid Formula: C17H14N2O4S MolecularWeight: 342.36906

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CC2=CC=C(O2)C3=NC4=CC=CC=C4S3)C(=O)O

Isomeric SMILES

C1C(CN(C1=O)CC2=CC=C(O2)C3=NC4=CC=CC=C4S3)C(=O)O

InChI

InChI=1S/C17H14N2O4S/c20-15-7-10(17(21)22)8-19(15)9-11-5-6-13(23-11)16-18-12-3-1-2-4-14(12)24-16/h1-6,10H,7-9H2,(H,21,22)