2-[2-[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]amino]-2-oxidanylidene-ethoxy]benzamide

Systemtic Name: 2-[2-[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]amino]-2-oxidanylidene-ethoxy]benzamide Openeye Name: 2-[2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]-2-oxo-ethoxy]benzamide CAS Name: 2-[2-[5-(1-azepanylsulfonyl)-2-methoxyanilino]-2-oxoethoxy]benzamide IUPAC Name: 2-[2-[5-(azepan-1-ylsulfonyl)-2-methoxyanilino]-2-oxoethoxy]benzamide Traditional Name: 2-[2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]-2-keto-ethoxy]benzamide Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)COC3=CC=CC=C3C(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)COC3=CC=CC=C3C(=O)N

InChI

InChI=1S/C22H27N3O6S/c1-30-20-11-10-16(32(28,29)25-12-6-2-3-7-13-25)14-18(20)24-21(26)15-31-19-9-5-4-8-17(19)22(23)27/h4-5,8-11,14H,2-3,6-7,12-13,15H2,1H3,(H2,23,27)(H,24,26)