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

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(2-chloranyl-4,5-dimethoxy-phenyl)-4-methoxy-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(2-chloro-4,5-dimethoxy-phenyl)-4-methoxy-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(2-chloro-4,5-dimethoxyphenyl)-4-methoxybenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(2-chloro-4,5-dimethoxyphenyl)-4-methoxybenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(2-chloro-4,5-dimethoxy-phenyl)-4-methoxy-benzamide Formula: C22H27ClN2O6S MolecularWeight: 482.97758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2Cl)OC)OC)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2Cl)OC)OC)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H27ClN2O6S/c1-29-18-9-8-15(12-21(18)32(27,28)25-10-6-4-5-7-11-25)22(26)24-17-14-20(31-3)19(30-2)13-16(17)23/h8-9,12-14H,4-7,10-11H2,1-3H3,(H,24,26)