1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-[(3,5-dimethylphenyl)methyl]piperazine

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-[(3,5-dimethylphenyl)methyl]piperazine Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-[(3,5-dimethylphenyl)methyl]piperazine CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-[(3,5-dimethylphenyl)methyl]piperazine IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-[(3,5-dimethylphenyl)methyl]piperazine Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-(3,5-dimethylbenzyl)piperazine Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CN2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4)C

Isomeric SMILES

CC1=CC(=CC(=C1)CN2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4)C

InChI

InChI=1S/C21H26N2O4S/c1-16-11-17(2)13-18(12-16)15-22-5-7-23(8-6-22)28(24,25)19-3-4-20-21(14-19)27-10-9-26-20/h3-4,11-14H,5-10,15H2,1-2H3