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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-(4-tert-butylphenoxy)butanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-(4-tert-butylphenoxy)butanamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-4-(4-tert-butylphenoxy)butanamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-(4-tert-butylphenoxy)butanamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-(4-tert-butylphenoxy)butyramide Formula: C26H36N2O4S MolecularWeight: 472.64004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H36N2O4S/c1-26(2,3)21-13-15-23(16-14-21)32-19-9-12-25(29)27-22-10-8-11-24(20-22)33(30,31)28-17-6-4-5-7-18-28/h8,10-11,13-16,20H,4-7,9,12,17-19H2,1-3H3,(H,27,29)