[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxy-benzoate

Systemtic Name: [2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxy-benzoate Openeye Name: [2-(3-iodoanilino)-2-oxo-ethyl] 5-indolin-1-ylsulfonyl-2-methoxy-benzoate CAS Name: 5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxybenzoic acid [2-(3-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-iodoanilino)-2-oxoethyl] 5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxybenzoate Traditional Name: 5-indolin-1-ylsulfonyl-2-methoxy-benzoic acid [2-(3-iodoanilino)-2-keto-ethyl] ester Formula: C24H21IN2O6S MolecularWeight: 592.40281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C32)C(=O)OCC(=O)NC4=CC(=CC=C4)I

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C32)C(=O)OCC(=O)NC4=CC(=CC=C4)I

InChI

InChI=1S/C24H21IN2O6S/c1-32-22-10-9-19(34(30,31)27-12-11-16-5-2-3-8-21(16)27)14-20(22)24(29)33-15-23(28)26-18-7-4-6-17(25)13-18/h2-10,13-14H,11-12,15H2,1H3,(H,26,28)