3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]peroxy-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]peroxy-3-oxidanylidene-propanoic acid Openeye Name: 3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]peroxy-3-oxo-propanoic acid CAS Name: 3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]dioxy-3-oxopropanoic acid IUPAC Name: 3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]peroxy-3-oxopropanoic acid Traditional Name: 3-[3-[2-[(4-chlorophenyl)sulfonylamino]ethyl]phenyl]peroxy-3-keto-propionic acid Formula: C17H16ClNO7S MolecularWeight: 413.82944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OOC(=O)CC(=O)O)CCNS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC(=CC(=C1)OOC(=O)CC(=O)O)CCNS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H16ClNO7S/c18-13-4-6-15(7-5-13)27(23,24)19-9-8-12-2-1-3-14(10-12)25-26-17(22)11-16(20)21/h1-7,10,19H,8-9,11H2,(H,20,21)