2-[(3Z)-3-(1,3-benzothiazol-2-ylmethylidene)-2-oxidanylidene-indol-1-yl]ethanoic acid

Systemtic Name: 2-[(3Z)-3-(1,3-benzothiazol-2-ylmethylidene)-2-oxidanylidene-indol-1-yl]ethanoic acid Openeye Name: 2-[(3Z)-3-(1,3-benzothiazol-2-ylmethylene)-2-oxo-indolin-1-yl]acetic acid CAS Name: 2-[(3Z)-3-(1,3-benzothiazol-2-ylmethylidene)-2-oxo-1-indolyl]acetic acid IUPAC Name: 2-[(3Z)-3-(1,3-benzothiazol-2-ylmethylidene)-2-oxoindol-1-yl]acetic acid Traditional Name: 2-[(3Z)-3-(1,3-benzothiazol-2-ylmethylene)-2-keto-indolin-1-yl]acetic acid Formula: C18H12N2O3S MolecularWeight: 336.36448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC3=NC4=CC=CC=C4S3)C(=O)N2CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)/C(=C/C3=NC4=CC=CC=C4S3)/C(=O)N2CC(=O)O

InChI

InChI=1S/C18H12N2O3S/c21-17(22)10-20-14-7-3-1-5-11(14)12(18(20)23)9-16-19-13-6-2-4-8-15(13)24-16/h1-9H,10H2,(H,21,22)/b12-9-