phenyl 4-(2-ethyl-4-phenoxysulfonyl-phenyl)piperazine-2-sulfonate

Systemtic Name: phenyl 4-(2-ethyl-4-phenoxysulfonyl-phenyl)piperazine-2-sulfonate Openeye Name: phenyl 4-(2-ethyl-4-phenoxysulfonyl-phenyl)piperazine-2-sulfonate CAS Name: 4-(2-ethyl-4-phenoxysulfonylphenyl)-2-piperazinesulfonic acid phenyl ester IUPAC Name: phenyl 4-(2-ethyl-4-phenoxysulfonylphenyl)piperazine-2-sulfonate Traditional Name: 4-(2-ethyl-4-phenoxysulfonyl-phenyl)piperazine-2-sulfonic acid phenyl ester Formula: C24H26N2O6S2 MolecularWeight: 502.60304

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)S(=O)(=O)OC2=CC=CC=C2)N3CCNC(C3)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CCC1=C(C=CC(=C1)S(=O)(=O)OC2=CC=CC=C2)N3CCNC(C3)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C24H26N2O6S2/c1-2-19-17-22(33(27,28)31-20-9-5-3-6-10-20)13-14-23(19)26-16-15-25-24(18-26)34(29,30)32-21-11-7-4-8-12-21/h3-14,17,24-25H,2,15-16,18H2,1H3