phenyl 2-(2-hydroxyphenyl)-1-oxidanylidene-3-phenyl-3-(propan-2-ylsulfonylcarbonylamino)propane-1-sulfonate

Systemtic Name: phenyl 2-(2-hydroxyphenyl)-1-oxidanylidene-3-phenyl-3-(propan-2-ylsulfonylcarbonylamino)propane-1-sulfonate Openeye Name: phenyl 2-(2-hydroxyphenyl)-3-(isopropylsulfonylcarbonylamino)-1-oxo-3-phenyl-propane-1-sulfonate CAS Name: 2-(2-hydroxyphenyl)-1-oxo-3-[[oxo(propan-2-ylsulfonyl)methyl]amino]-3-phenyl-1-propanesulfonic acid IUPAC Name: phenyl 2-(2-hydroxyphenyl)-1-oxo-3-phenyl-3-(propan-2-ylsulfonylcarbonylamino)propane-1-sulfonate Traditional Name: 2-(2-hydroxyphenyl)-3-(isopropylsulfonylcarbonylamino)-1-keto-3-phenyl-propane-1-sulfonic acid phenyl ester Formula: C25H25NO8S2 MolecularWeight: 531.5979

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C(=O)NC(C1=CC=CC=C1)C(C2=CC=CC=C2O)C(=O)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

CC(C)S(=O)(=O)C(=O)NC(C1=CC=CC=C1)C(C2=CC=CC=C2O)C(=O)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C25H25NO8S2/c1-17(2)35(30,31)25(29)26-23(18-11-5-3-6-12-18)22(20-15-9-10-16-21(20)27)24(28)36(32,33)34-19-13-7-4-8-14-19/h3-17,22-23,27H,1-2H3,(H,26,29)