phenyl 1-oxidanylidene-3-phenyl-3-(2-phenylethanoylamino)-2-(phenylmethyl)propane-1-sulfonate

Systemtic Name: phenyl 1-oxidanylidene-3-phenyl-3-(2-phenylethanoylamino)-2-(phenylmethyl)propane-1-sulfonate Openeye Name: phenyl 2-benzyl-1-oxo-3-phenyl-3-[(2-phenylacetyl)amino]propane-1-sulfonate CAS Name: 1-oxo-3-[(1-oxo-2-phenylethyl)amino]-3-phenyl-2-(phenylmethyl)-1-propanesulfonic acid IUPAC Name: phenyl 2-benzyl-1-oxo-3-phenyl-3-[(2-phenylacetyl)amino]propane-1-sulfonate Traditional Name: 2-benzyl-1-keto-3-phenyl-3-[(2-phenylacetyl)amino]propane-1-sulfonic acid phenyl ester Formula: C30H27NO5S MolecularWeight: 513.60408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(C2=CC=CC=C2)NC(=O)CC3=CC=CC=C3)C(=O)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC(C(C2=CC=CC=C2)NC(=O)CC3=CC=CC=C3)C(=O)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C30H27NO5S/c32-28(22-24-15-7-2-8-16-24)31-29(25-17-9-3-10-18-25)27(21-23-13-5-1-6-14-23)30(33)37(34,35)36-26-19-11-4-12-20-26/h1-20,27,29H,21-22H2,(H,31,32)