N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-benzodioxol-5-yloxy)ethanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-benzodioxol-5-yloxy)ethanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-benzodioxol-5-yloxy)acetamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-(1,3-benzodioxol-5-yloxy)acetamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-benzodioxol-5-yloxy)acetamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(1,3-benzodioxol-5-yloxy)acetamide Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H24N2O6S/c24-21(14-27-17-7-10-19-20(13-17)29-15-28-19)22-16-5-8-18(9-6-16)30(25,26)23-11-3-1-2-4-12-23/h5-10,13H,1-4,11-12,14-15H2,(H,22,24)