[2-[(4-iodophenyl)sulfonylamino]-3-oxidanylidene-3-phenylazanyl-propyl] methanesulfonate

Systemtic Name: [2-[(4-iodophenyl)sulfonylamino]-3-oxidanylidene-3-phenylazanyl-propyl] methanesulfonate Openeye Name: [3-anilino-2-[(4-iodophenyl)sulfonylamino]-3-oxo-propyl] methanesulfonate CAS Name: methanesulfonic acid [3-anilino-2-[(4-iodophenyl)sulfonylamino]-3-oxopropyl] ester IUPAC Name: [3-anilino-2-[(4-iodophenyl)sulfonylamino]-3-oxopropyl] methanesulfonate Traditional Name: methanesulfonic acid [3-anilino-2-[(4-iodophenyl)sulfonylamino]-3-keto-propyl] ester Formula: C16H17IN2O6S2 MolecularWeight: 524.35045

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC(C(=O)NC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)I

Isomeric SMILES

CS(=O)(=O)OCC(C(=O)NC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)I

InChI

InChI=1S/C16H17IN2O6S2/c1-26(21,22)25-11-15(16(20)18-13-5-3-2-4-6-13)19-27(23,24)14-9-7-12(17)8-10-14/h2-10,15,19H,11H2,1H3,(H,18,20)