N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[4-(phenylcarbonyl)phenoxy]ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[4-(phenylcarbonyl)phenoxy]ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(4-benzoylphenoxy)acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-(4-benzoylphenoxy)acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-(4-benzoylphenoxy)acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(4-benzoylphenoxy)acetamide Formula: C28H30N2O6S MolecularWeight: 522.6126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)COC3=CC=C(C=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)COC3=CC=C(C=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H30N2O6S/c1-35-26-16-15-24(37(33,34)30-17-7-2-3-8-18-30)19-25(26)29-27(31)20-36-23-13-11-22(12-14-23)28(32)21-9-5-4-6-10-21/h4-6,9-16,19H,2-3,7-8,17-18,20H2,1H3,(H,29,31)