1-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-2-(2-chloranyl-4-phenyl-phenoxy)ethanone

Systemtic Name: 1-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-2-(2-chloranyl-4-phenyl-phenoxy)ethanone Openeye Name: 1-[4-(azepane-1-carbonyl)-1-piperidyl]-2-(2-chloro-4-phenyl-phenoxy)ethanone CAS Name: 1-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-2-(2-chloro-4-phenylphenoxy)ethanone IUPAC Name: 1-[4-(azepane-1-carbonyl)piperidin-1-yl]-2-(2-chloro-4-phenylphenoxy)ethanone Traditional Name: 1-[4-(azepane-1-carbonyl)piperidino]-2-(2-chloro-4-phenyl-phenoxy)ethanone Formula: C26H31ClN2O3 MolecularWeight: 454.98894

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)COC3=C(C=C(C=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)COC3=C(C=C(C=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C26H31ClN2O3/c27-23-18-22(20-8-4-3-5-9-20)10-11-24(23)32-19-25(30)28-16-12-21(13-17-28)26(31)29-14-6-1-2-7-15-29/h3-5,8-11,18,21H,1-2,6-7,12-17,19H2