3-[(2-oxidanylidene-3-propan-2-ylidene-1H-indol-5-yl)sulfonyl]propanoic acid

Systemtic Name: 3-[(2-oxidanylidene-3-propan-2-ylidene-1H-indol-5-yl)sulfonyl]propanoic acid Openeye Name: 3-(3-isopropylidene-2-oxo-indolin-5-yl)sulfonylpropanoic acid CAS Name: 3-[(2-oxo-3-propan-2-ylidene-1H-indol-5-yl)sulfonyl]propanoic acid IUPAC Name: 3-[(2-oxo-3-propan-2-ylidene-1H-indol-5-yl)sulfonyl]propanoic acid Traditional Name: 3-(3-isopropylidene-2-keto-indolin-5-yl)sulfonylpropionic acid Formula: C14H15NO5S MolecularWeight: 309.3376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C2=C(C=CC(=C2)S(=O)(=O)CCC(=O)O)NC1=O)C

Isomeric SMILES

CC(=C1C2=C(C=CC(=C2)S(=O)(=O)CCC(=O)O)NC1=O)C

InChI

InChI=1S/C14H15NO5S/c1-8(2)13-10-7-9(3-4-11(10)15-14(13)18)21(19,20)6-5-12(16)17/h3-4,7H,5-6H2,1-2H3,(H,15,18)(H,16,17)