1-(2,3-dihydro-1,4-benzodioxin-5-yl)-4-[3-(phenylsulfonyl)propyl]piperazine

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-5-yl)-4-[3-(phenylsulfonyl)propyl]piperazine Openeye Name: 1-[3-(benzenesulfonyl)propyl]-4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazine CAS Name: 1-[3-(benzenesulfonyl)propyl]-4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazine IUPAC Name: 1-[3-(benzenesulfonyl)propyl]-4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazine Traditional Name: 1-(3-besylpropyl)-4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazine Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCS(=O)(=O)C2=CC=CC=C2)C3=C4C(=CC=C3)OCCO4

Isomeric SMILES

C1CN(CCN1CCCS(=O)(=O)C2=CC=CC=C2)C3=C4C(=CC=C3)OCCO4

InChI

InChI=1S/C21H26N2O4S/c24-28(25,18-6-2-1-3-7-18)17-5-10-22-11-13-23(14-12-22)19-8-4-9-20-21(19)27-16-15-26-20/h1-4,6-9H,5,10-17H2