1-(2,3-dimethylphenyl)-4-[(2,2-diphenyl-1,3-benzodioxol-5-yl)sulfonyl]piperazine

Systemtic Name: 1-(2,3-dimethylphenyl)-4-[(2,2-diphenyl-1,3-benzodioxol-5-yl)sulfonyl]piperazine Openeye Name: 1-(2,3-dimethylphenyl)-4-[(2,2-diphenyl-1,3-benzodioxol-5-yl)sulfonyl]piperazine CAS Name: 1-(2,3-dimethylphenyl)-4-[(2,2-diphenyl-1,3-benzodioxol-5-yl)sulfonyl]piperazine IUPAC Name: 1-(2,3-dimethylphenyl)-4-[(2,2-diphenyl-1,3-benzodioxol-5-yl)sulfonyl]piperazine Traditional Name: 1-(2,3-dimethylphenyl)-4-[(2,2-diphenyl-1,3-benzodioxol-5-yl)sulfonyl]piperazine Formula: C31H30N2O4S MolecularWeight: 526.6459

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OC(O4)(C5=CC=CC=C5)C6=CC=CC=C6)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OC(O4)(C5=CC=CC=C5)C6=CC=CC=C6)C

InChI

InChI=1S/C31H30N2O4S/c1-23-10-9-15-28(24(23)2)32-18-20-33(21-19-32)38(34,35)27-16-17-29-30(22-27)37-31(36-29,25-11-5-3-6-12-25)26-13-7-4-8-14-26/h3-17,22H,18-21H2,1-2H3