3-(azepan-1-ylsulfonyl)-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-4-methoxy-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-4-methoxy-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(4-chloro-2-methoxy-5-methyl-phenyl)-4-methoxy-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(4-chloro-2-methoxy-5-methylphenyl)-4-methoxybenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(4-chloro-2-methoxy-5-methylphenyl)-4-methoxybenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(4-chloro-2-methoxy-5-methyl-phenyl)-4-methoxy-benzamide Formula: C22H27ClN2O5S MolecularWeight: 466.97818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H27ClN2O5S/c1-15-12-18(20(30-3)14-17(15)23)24-22(26)16-8-9-19(29-2)21(13-16)31(27,28)25-10-6-4-5-7-11-25/h8-9,12-14H,4-7,10-11H2,1-3H3,(H,24,26)