phenyl 4-[2-(oxidanylamino)-1-(4-phenylphenyl)ethyl]piperazine-2-sulfonate

Systemtic Name: phenyl 4-[2-(oxidanylamino)-1-(4-phenylphenyl)ethyl]piperazine-2-sulfonate Openeye Name: phenyl 4-[2-(hydroxyamino)-1-(4-phenylphenyl)ethyl]piperazine-2-sulfonate CAS Name: 4-[2-(hydroxyamino)-1-(4-phenylphenyl)ethyl]-2-piperazinesulfonic acid phenyl ester IUPAC Name: phenyl 4-[2-(hydroxyamino)-1-(4-phenylphenyl)ethyl]piperazine-2-sulfonate Traditional Name: 4-[2-(hydroxyamino)-1-(4-phenylphenyl)ethyl]piperazine-2-sulfonic acid phenyl ester Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)S(=O)(=O)OC2=CC=CC=C2)C(CNO)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC(N1)S(=O)(=O)OC2=CC=CC=C2)C(CNO)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3O4S/c28-26-17-23(21-13-11-20(12-14-21)19-7-3-1-4-8-19)27-16-15-25-24(18-27)32(29,30)31-22-9-5-2-6-10-22/h1-14,23-26,28H,15-18H2