N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(6-methoxybenzofuran-3-yl)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-(6-methoxy-3-benzofuranyl)acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(6-methoxybenzofuran-3-yl)acetamide Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CO2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CO2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H26N2O5S/c1-29-19-9-10-21-17(16-30-22(21)15-19)13-23(26)24-18-7-6-8-20(14-18)31(27,28)25-11-4-2-3-5-12-25/h6-10,14-16H,2-5,11-13H2,1H3,(H,24,26)