methyl 2-[[4-[(2,4-dichlorophenyl)carbonylamino]phenyl]sulfonylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[[4-[(2,4-dichlorophenyl)carbonylamino]phenyl]sulfonylamino]-3-oxidanyl-propanoate Openeye Name: methyl 2-[[4-[(2,4-dichlorobenzoyl)amino]phenyl]sulfonylamino]-3-hydroxy-propanoate CAS Name: 2-[[4-[[(2,4-dichlorophenyl)-oxomethyl]amino]phenyl]sulfonylamino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-[[4-[(2,4-dichlorobenzoyl)amino]phenyl]sulfonylamino]-3-hydroxypropanoate Traditional Name: 2-[[4-[(2,4-dichlorobenzoyl)amino]phenyl]sulfonylamino]-3-hydroxy-propionic acid methyl ester Formula: C17H16Cl2N2O6S MolecularWeight: 447.28974

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

COC(=O)C(CO)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H16Cl2N2O6S/c1-27-17(24)15(9-22)21-28(25,26)12-5-3-11(4-6-12)20-16(23)13-7-2-10(18)8-14(13)19/h2-8,15,21-22H,9H2,1H3,(H,20,23)