(2R)-N-(1,3-benzodioxol-5-yl)-2-[4-(phenylsulfonyl)piperazin-1-yl]propanamide

Systemtic Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-[4-(phenylsulfonyl)piperazin-1-yl]propanamide Openeye Name: (2R)-2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(1,3-benzodioxol-5-yl)propanamide CAS Name: (2R)-2-[4-(benzenesulfonyl)-1-piperazinyl]-N-(1,3-benzodioxol-5-yl)propanamide IUPAC Name: (2R)-2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(1,3-benzodioxol-5-yl)propanamide Traditional Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(4-besylpiperazino)propionamide Formula: C20H23N3O5S MolecularWeight: 417.47872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCO2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=C(C=C1)OCO2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H23N3O5S/c1-15(20(24)21-16-7-8-18-19(13-16)28-14-27-18)22-9-11-23(12-10-22)29(25,26)17-5-3-2-4-6-17/h2-8,13,15H,9-12,14H2,1H3,(H,21,24)/t15-/m1/s1