N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetamide Formula: C22H25ClN2O5S MolecularWeight: 464.9623

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3=CC4=C(C(=C3)Cl)OCCO4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3=CC4=C(C(=C3)Cl)OCCO4

InChI

InChI=1S/C22H25ClN2O5S/c23-19-13-16(14-20-22(19)30-12-11-29-20)15-21(26)24-17-5-7-18(8-6-17)31(27,28)25-9-3-1-2-4-10-25/h5-8,13-14H,1-4,9-12,15H2,(H,24,26)