[3-(aminocarbonylamino)-2-(2,4-dichlorophenyl)carbonyl-3a,4-dihydro-1-benzofuran-6-yl] methanesulfonate

Systemtic Name: [3-(aminocarbonylamino)-2-(2,4-dichlorophenyl)carbonyl-3a,4-dihydro-1-benzofuran-6-yl] methanesulfonate Openeye Name: [2-(2,4-dichlorobenzoyl)-3-ureido-3a,4-dihydrobenzofuran-6-yl] methanesulfonate CAS Name: methanesulfonic acid [3-(carbamoylamino)-2-[(2,4-dichlorophenyl)-oxomethyl]-3a,4-dihydrobenzofuran-6-yl] ester IUPAC Name: [3-(carbamoylamino)-2-(2,4-dichlorobenzoyl)-3a,4-dihydro-1-benzofuran-6-yl] methanesulfonate Traditional Name: methanesulfonic acid [2-(2,4-dichlorobenzoyl)-3-ureido-3a,4-dihydrobenzofuran-6-yl] ester Formula: C17H14Cl2N2O6S MolecularWeight: 445.27386

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CCC2C(=C1)OC(=C2NC(=O)N)C(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CS(=O)(=O)OC1=CCC2C(=C1)OC(=C2NC(=O)N)C(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H14Cl2N2O6S/c1-28(24,25)27-9-3-5-11-13(7-9)26-16(14(11)21-17(20)23)15(22)10-4-2-8(18)6-12(10)19/h2-4,6-7,11H,5H2,1H3,(H3,20,21,23)