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

Systemtic Name: phenyl 1-oxidanylidene-1,3-diphenyl-3-(propan-2-ylsulfonylcarbonylamino)propane-2-sulfonate Openeye Name: phenyl 1-(isopropylsulfonylcarbonylamino)-3-oxo-1,3-diphenyl-propane-2-sulfonate CAS Name: 1-oxo-3-[[oxo(propan-2-ylsulfonyl)methyl]amino]-1,3-diphenyl-2-propanesulfonic acid IUPAC Name: phenyl 1-oxo-1,3-diphenyl-3-(propan-2-ylsulfonylcarbonylamino)propane-2-sulfonate Traditional Name: 1-(isopropylsulfonylcarbonylamino)-3-keto-1,3-diphenyl-propane-2-sulfonic acid phenyl ester Formula: C25H25NO7S2 MolecularWeight: 515.5985

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25NO7S2/c1-18(2)34(29,30)25(28)26-22(19-12-6-3-7-13-19)24(23(27)20-14-8-4-9-15-20)35(31,32)33-21-16-10-5-11-17-21/h3-18,22,24H,1-2H3,(H,26,28)