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

Systemtic Name: 1-(2-chloranylprop-2-enyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazine Openeye Name: 1-(2-chloroallyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazine CAS Name: 1-(2-chloroprop-2-enyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazine IUPAC Name: 1-(2-chloroprop-2-enyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazine Traditional Name: 1-(2-chloroallyl)-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperazine Formula: C16H21ClN2O4S MolecularWeight: 372.86694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C(CN1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3)Cl

Isomeric SMILES

C=C(CN1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3)Cl

InChI

InChI=1S/C16H21ClN2O4S/c1-13(17)12-18-5-7-19(8-6-18)24(20,21)14-3-4-15-16(11-14)23-10-2-9-22-15/h3-4,11H,1-2,5-10,12H2