N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N-methyl-azepane-1-sulfonamide

Systemtic Name: N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N-methyl-azepane-1-sulfonamide Openeye Name: N-[(4-benzyloxy-3-methoxy-phenyl)methyl]-N-methyl-azepane-1-sulfonamide CAS Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-N-methyl-1-azepanesulfonamide IUPAC Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-N-methylazepane-1-sulfonamide Traditional Name: N-(4-benzoxy-3-methoxy-benzyl)-N-methyl-azepane-1-sulfonamide Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H30N2O4S/c1-23(29(25,26)24-14-8-3-4-9-15-24)17-20-12-13-21(22(16-20)27-2)28-18-19-10-6-5-7-11-19/h5-7,10-13,16H,3-4,8-9,14-15,17-18H2,1-2H3