3-[(E)-(2-oxidanylidene-5-sulfamoyl-1H-indol-3-ylidene)methyl]-4,5,6,7-tetrahydro-2H-isoindole-1-carboxylic acid

Systemtic Name: 3-[(E)-(2-oxidanylidene-5-sulfamoyl-1H-indol-3-ylidene)methyl]-4,5,6,7-tetrahydro-2H-isoindole-1-carboxylic acid Openeye Name: 3-[(E)-(2-oxo-5-sulfamoyl-indolin-3-ylidene)methyl]-4,5,6,7-tetrahydro-2H-isoindole-1-carboxylic acid CAS Name: 3-[(E)-(2-oxo-5-sulfamoyl-1H-indol-3-ylidene)methyl]-4,5,6,7-tetrahydro-2H-isoindole-1-carboxylic acid IUPAC Name: 3-[(E)-(2-oxo-5-sulfamoyl-1H-indol-3-ylidene)methyl]-4,5,6,7-tetrahydro-2H-isoindole-1-carboxylic acid Traditional Name: 3-[(E)-(2-keto-5-sulfamoyl-indolin-3-ylidene)methyl]-4,5,6,7-tetrahydro-2H-isoindole-1-carboxylic acid Formula: C18H17N3O5S MolecularWeight: 387.40968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(NC(=C2C1)C=C3C4=C(C=CC(=C4)S(=O)(=O)N)NC3=O)C(=O)O

Isomeric SMILES

C1CCC2=C(NC(=C2C1)/C=C/3\C4=C(C=CC(=C4)S(=O)(=O)N)NC3=O)C(=O)O

InChI

InChI=1S/C18H17N3O5S/c19-27(25,26)9-5-6-14-12(7-9)13(17(22)21-14)8-15-10-3-1-2-4-11(10)16(20-15)18(23)24/h5-8,20H,1-4H2,(H,21,22)(H,23,24)(H2,19,25,26)/b13-8+