N-[3-(azepan-1-ylsulfonyl)phenyl]-4-(4-methoxyphenoxy)butanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-(4-methoxyphenoxy)butanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-(4-methoxyphenoxy)butanamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-4-(4-methoxyphenoxy)butanamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-(4-methoxyphenoxy)butanamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-(4-methoxyphenoxy)butyramide Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)OCCCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H30N2O5S/c1-29-20-11-13-21(14-12-20)30-17-7-10-23(26)24-19-8-6-9-22(18-19)31(27,28)25-15-4-2-3-5-16-25/h6,8-9,11-14,18H,2-5,7,10,15-17H2,1H3,(H,24,26)