1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-prop-2-enyl-piperazine

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-prop-2-enyl-piperazine Openeye Name: 1-allyl-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazine CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-prop-2-enylpiperazine IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-prop-2-enylpiperazine Traditional Name: 1-allyl-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazine Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

C=CCN1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C16H22N2O4S/c1-2-6-17-7-9-18(10-8-17)23(19,20)14-4-5-15-16(13-14)22-12-3-11-21-15/h2,4-5,13H,1,3,6-12H2