N-[4-(azepan-1-ylsulfonyl)phenyl]-5-bromanyl-2-hexoxy-benzamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-bromanyl-2-hexoxy-benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-bromo-2-hexoxy-benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-5-bromo-2-hexoxybenzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-bromo-2-hexoxybenzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-bromo-2-hexoxy-benzamide Formula: C25H33BrN2O4S MolecularWeight: 537.50952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C25H33BrN2O4S/c1-2-3-4-9-18-32-24-15-10-20(26)19-23(24)25(29)27-21-11-13-22(14-12-21)33(30,31)28-16-7-5-6-8-17-28/h10-15,19H,2-9,16-18H2,1H3,(H,27,29)