5-(azepan-1-ylsulfonyl)-N-(3-ethoxyphenyl)-2-methoxy-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-(3-ethoxyphenyl)-2-methoxy-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(3-ethoxyphenyl)-2-methoxy-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-(3-ethoxyphenyl)-2-methoxybenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(3-ethoxyphenyl)-2-methoxybenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-m-phenetyl-benzamide Formula: C22H28N2O5S MolecularWeight: 432.53312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CCOC1=CC=CC(=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C22H28N2O5S/c1-3-29-18-10-8-9-17(15-18)23-22(25)20-16-19(11-12-21(20)28-2)30(26,27)24-13-6-4-5-7-14-24/h8-12,15-16H,3-7,13-14H2,1-2H3,(H,23,25)