3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)benzamide Formula: C22H25ClN2O5S MolecularWeight: 464.9623

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=CC4=C(C=C3)OCCO4)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC3=CC4=C(C=C3)OCCO4)Cl

InChI

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