[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 3-(1,3-benzothiazol-2-yl)propanoate

Systemtic Name: [3-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 3-(1,3-benzothiazol-2-yl)propanoate Openeye Name: [3-(2-oxopyrrolidin-1-yl)phenyl] 3-(1,3-benzothiazol-2-yl)propanoate CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid [3-(2-oxo-1-pyrrolidinyl)phenyl] ester IUPAC Name: [3-(2-oxopyrrolidin-1-yl)phenyl] 3-(1,3-benzothiazol-2-yl)propanoate Traditional Name: 3-(1,3-benzothiazol-2-yl)propionic acid [3-(2-ketopyrrolidino)phenyl] ester Formula: C20H18N2O3S MolecularWeight: 366.43352

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC(=CC=C2)OC(=O)CCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC(=O)N(C1)C2=CC(=CC=C2)OC(=O)CCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H18N2O3S/c23-19-9-4-12-22(19)14-5-3-6-15(13-14)25-20(24)11-10-18-21-16-7-1-2-8-17(16)26-18/h1-3,5-8,13H,4,9-12H2