3-(azepan-1-ylsulfonyl)-N-[2-(4-methylphenoxy)ethyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[2-(4-methylphenoxy)ethyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[2-(4-methylphenoxy)ethyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[2-(4-methylphenoxy)ethyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[2-(4-methylphenoxy)ethyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[2-(4-methylphenoxy)ethyl]benzamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)OCCNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H28N2O4S/c1-18-9-11-20(12-10-18)28-16-13-23-22(25)19-7-6-8-21(17-19)29(26,27)24-14-4-2-3-5-15-24/h6-12,17H,2-5,13-16H2,1H3,(H,23,25)