[2-[(4-iodanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 4,5-dimethoxy-2-(thiophen-2-ylcarbonylamino)benzoate

Systemtic Name: [2-[(4-iodanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 4,5-dimethoxy-2-(thiophen-2-ylcarbonylamino)benzoate Openeye Name: [2-(4-iodo-2-methyl-anilino)-2-oxo-ethyl] 4,5-dimethoxy-2-(thiophene-2-carbonylamino)benzoate CAS Name: 4,5-dimethoxy-2-[[oxo(thiophen-2-yl)methyl]amino]benzoic acid [2-(4-iodo-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-iodo-2-methylanilino)-2-oxoethyl] 4,5-dimethoxy-2-(thiophene-2-carbonylamino)benzoate Traditional Name: 4,5-dimethoxy-2-(2-thenoylamino)benzoic acid [2-(4-iodo-2-methyl-anilino)-2-keto-ethyl] ester Formula: C23H21IN2O6S MolecularWeight: 580.39211

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)COC(=O)C2=CC(=C(C=C2NC(=O)C3=CC=CS3)OC)OC

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)COC(=O)C2=CC(=C(C=C2NC(=O)C3=CC=CS3)OC)OC

InChI

InChI=1S/C23H21IN2O6S/c1-13-9-14(24)6-7-16(13)25-21(27)12-32-23(29)15-10-18(30-2)19(31-3)11-17(15)26-22(28)20-5-4-8-33-20/h4-11H,12H2,1-3H3,(H,25,27)(H,26,28)