N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-(2-ethoxyphenoxy)butanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-(2-ethoxyphenoxy)butanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-(2-ethoxyphenoxy)butanamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-4-(2-ethoxyphenoxy)butanamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-4-(2-ethoxyphenoxy)butanamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-(2-ethoxyphenoxy)butyramide Formula: C25H34N2O6S MolecularWeight: 490.61226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OCCCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CCOC1=CC=CC=C1OCCCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C25H34N2O6S/c1-3-32-23-11-6-7-12-24(23)33-18-10-13-25(28)26-21-19-20(14-15-22(21)31-2)34(29,30)27-16-8-4-5-9-17-27/h6-7,11-12,14-15,19H,3-5,8-10,13,16-18H2,1-2H3,(H,26,28)