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

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(6-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-4-methoxy-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-4-methoxy-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-4-methoxybenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-4-methoxybenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-4-methoxy-benzamide Formula: C22H25ClN2O6S MolecularWeight: 480.9617

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2Cl)OCCO3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2Cl)OCCO3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C22H25ClN2O6S/c1-29-18-7-6-15(12-21(18)32(27,28)25-8-4-2-3-5-9-25)22(26)24-17-14-20-19(13-16(17)23)30-10-11-31-20/h6-7,12-14H,2-5,8-11H2,1H3,(H,24,26)