3-(azepan-1-ylsulfonyl)-N-(6-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(6-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)benzamide Formula: C21H23ClN2O5S MolecularWeight: 450.93572

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC4=C(C=C3Cl)OCCO4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC4=C(C=C3Cl)OCCO4

InChI

InChI=1S/C21H23ClN2O5S/c22-17-13-19-20(29-11-10-28-19)14-18(17)23-21(25)15-6-5-7-16(12-15)30(26,27)24-8-3-1-2-4-9-24/h5-7,12-14H,1-4,8-11H2,(H,23,25)