5-(azepan-1-ylsulfonyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methoxy-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methoxy-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methoxy-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methoxybenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methoxybenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methoxy-benzamide Formula: C23H28N2O6S MolecularWeight: 460.54322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C23H28N2O6S/c1-29-20-10-8-18(32(27,28)25-11-4-2-3-5-12-25)16-19(20)23(26)24-17-7-9-21-22(15-17)31-14-6-13-30-21/h7-10,15-16H,2-6,11-14H2,1H3,(H,24,26)