N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(4-chloranylphenoxy)-2-methyl-propanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(4-chloranylphenoxy)-2-methyl-propanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(4-chlorophenoxy)-2-methyl-propanamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-(4-chlorophenoxy)-2-methylpropanamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-(4-chlorophenoxy)-2-methylpropanamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(4-chlorophenoxy)-2-methyl-propionamide Formula: C23H29ClN2O5S MolecularWeight: 481.00476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)OC)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)OC)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H29ClN2O5S/c1-23(2,31-18-10-8-17(24)9-11-18)22(27)25-20-16-19(12-13-21(20)30-3)32(28,29)26-14-6-4-5-7-15-26/h8-13,16H,4-7,14-15H2,1-3H3,(H,25,27)