3-(azepan-1-ylsulfonyl)-N-(3,4,5-trimethoxyphenyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(3,4,5-trimethoxyphenyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(3,4,5-trimethoxyphenyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(3,4,5-trimethoxyphenyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(3,4,5-trimethoxyphenyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(3,4,5-trimethoxyphenyl)benzamide Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H28N2O6S/c1-28-19-14-17(15-20(29-2)21(19)30-3)23-22(25)16-9-8-10-18(13-16)31(26,27)24-11-6-4-5-7-12-24/h8-10,13-15H,4-7,11-12H2,1-3H3,(H,23,25)