3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]benzamide Formula: C23H27ClN2O5S MolecularWeight: 478.98888

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCC3=CC4=C(C=C3)OCCO4)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCC3=CC4=C(C=C3)OCCO4)Cl

InChI

InChI=1S/C23H27ClN2O5S/c24-19-7-6-18(16-22(19)32(28,29)26-11-3-1-2-4-12-26)23(27)25-10-9-17-5-8-20-21(15-17)31-14-13-30-20/h5-8,15-16H,1-4,9-14H2,(H,25,27)