1-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-2-(3,4-dimethylphenoxy)ethanone

Systemtic Name: 1-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-2-(3,4-dimethylphenoxy)ethanone Openeye Name: 1-[4-(azepane-1-carbonyl)-1-piperidyl]-2-(3,4-dimethylphenoxy)ethanone CAS Name: 1-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-2-(3,4-dimethylphenoxy)ethanone IUPAC Name: 1-[4-(azepane-1-carbonyl)piperidin-1-yl]-2-(3,4-dimethylphenoxy)ethanone Traditional Name: 1-[4-(azepane-1-carbonyl)piperidino]-2-(3,4-dimethylphenoxy)ethanone Formula: C22H32N2O3 MolecularWeight: 372.50108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(=O)N2CCC(CC2)C(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC(=O)N2CCC(CC2)C(=O)N3CCCCCC3)C

InChI

InChI=1S/C22H32N2O3/c1-17-7-8-20(15-18(17)2)27-16-21(25)23-13-9-19(10-14-23)22(26)24-11-5-3-4-6-12-24/h7-8,15,19H,3-6,9-14,16H2,1-2H3