N-[4-(azepan-1-ylsulfonyl)phenyl]-2-benzo[e][1]benzofuran-1-yl-ethanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-benzo[e][1]benzofuran-1-yl-ethanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-benzo[e]benzofuran-1-yl-acetamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-(1-benzo[e]benzofuranyl)acetamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-benzo[e][1]benzofuran-1-ylacetamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-benzo[e]benzofuran-1-yl-acetamide Formula: C26H26N2O4S MolecularWeight: 462.56064

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3=COC4=C3C5=CC=CC=C5C=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3=COC4=C3C5=CC=CC=C5C=C4

InChI

InChI=1S/C26H26N2O4S/c29-25(17-20-18-32-24-14-9-19-7-3-4-8-23(19)26(20)24)27-21-10-12-22(13-11-21)33(30,31)28-15-5-1-2-6-16-28/h3-4,7-14,18H,1-2,5-6,15-17H2,(H,27,29)