N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromanyl-4-hexoxy-benzamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromanyl-4-hexoxy-benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromo-4-hexoxy-benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-3-bromo-4-hexoxybenzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromo-4-hexoxybenzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-bromo-4-hexoxy-benzamide Formula: C25H33BrN2O4S MolecularWeight: 537.50952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33BrN2O4S/c1-2-3-4-9-18-32-24-15-10-20(19-23(24)26)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)