phenyl 4-[4-oxidanyl-2-(phenylmethyl)phenyl]piperazine-2-sulfonate

Systemtic Name: phenyl 4-[4-oxidanyl-2-(phenylmethyl)phenyl]piperazine-2-sulfonate Openeye Name: phenyl 4-(2-benzyl-4-hydroxy-phenyl)piperazine-2-sulfonate CAS Name: 4-[4-hydroxy-2-(phenylmethyl)phenyl]-2-piperazinesulfonic acid phenyl ester IUPAC Name: phenyl 4-(2-benzyl-4-hydroxyphenyl)piperazine-2-sulfonate Traditional Name: 4-(2-benzyl-4-hydroxy-phenyl)piperazine-2-sulfonic acid phenyl ester Formula: C23H24N2O4S MolecularWeight: 424.51266

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)S(=O)(=O)OC2=CC=CC=C2)C3=C(C=C(C=C3)O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC(N1)S(=O)(=O)OC2=CC=CC=C2)C3=C(C=C(C=C3)O)CC4=CC=CC=C4

InChI

InChI=1S/C23H24N2O4S/c26-20-11-12-22(19(16-20)15-18-7-3-1-4-8-18)25-14-13-24-23(17-25)30(27,28)29-21-9-5-2-6-10-21/h1-12,16,23-24,26H,13-15,17H2