N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-(3,4-dimethoxyphenyl)methanesulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-(3,4-dimethoxyphenyl)methanesulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-N-(3,4-dimethoxyphenyl)methanesulfonamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-N-(3,4-dimethoxyphenyl)methanesulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-N-(3,4-dimethoxyphenyl)methanesulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-N-(3,4-dimethoxyphenyl)methanesulfonamide Formula: C17H26N2O5S MolecularWeight: 370.46374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC(=O)N2CCCCCC2)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC(=O)N2CCCCCC2)S(=O)(=O)C)OC

InChI

InChI=1S/C17H26N2O5S/c1-23-15-9-8-14(12-16(15)24-2)19(25(3,21)22)13-17(20)18-10-6-4-5-7-11-18/h8-9,12H,4-7,10-11,13H2,1-3H3