4-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-N,N-dimethyl-piperazine-1-sulfonamide

Systemtic Name: 4-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-N,N-dimethyl-piperazine-1-sulfonamide Openeye Name: 4-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-N,N-dimethyl-piperazine-1-sulfonamide CAS Name: 4-[(E)-3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]-N,N-dimethyl-1-piperazinesulfonamide IUPAC Name: 4-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-N,N-dimethylpiperazine-1-sulfonamide Traditional Name: 4-[(E)-3-(1,3-benzodioxol-5-yl)acryloyl]-N,N-dimethyl-piperazine-1-sulfonamide Formula: C16H21N3O5S MolecularWeight: 367.42004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H21N3O5S/c1-17(2)25(21,22)19-9-7-18(8-10-19)16(20)6-4-13-3-5-14-15(11-13)24-12-23-14/h3-6,11H,7-10,12H2,1-2H3/b6-4+