2-[[1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]-methyl-amino]-N-(3,4-diethoxyphenyl)ethanamide

Systemtic Name: 2-[[1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]-methyl-amino]-N-(3,4-diethoxyphenyl)ethanamide Openeye Name: 2-[[2-(azepan-1-yl)-1-methyl-2-oxo-ethyl]-methyl-amino]-N-(3,4-diethoxyphenyl)acetamide CAS Name: 2-[[1-(1-azepanyl)-1-oxopropan-2-yl]-methylamino]-N-(3,4-diethoxyphenyl)acetamide IUPAC Name: 2-[[1-(azepan-1-yl)-1-oxopropan-2-yl]-methylamino]-N-(3,4-diethoxyphenyl)acetamide Traditional Name: 2-[[2-(azepan-1-yl)-2-keto-1-methyl-ethyl]-methyl-amino]-N-(3,4-diethoxyphenyl)acetamide Formula: C22H35N3O4 MolecularWeight: 405.531

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CN(C)C(C)C(=O)N2CCCCCC2)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CN(C)C(C)C(=O)N2CCCCCC2)OCC

InChI

InChI=1S/C22H35N3O4/c1-5-28-19-12-11-18(15-20(19)29-6-2)23-21(26)16-24(4)17(3)22(27)25-13-9-7-8-10-14-25/h11-12,15,17H,5-10,13-14,16H2,1-4H3,(H,23,26)