1-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidin-1-yl]sulfonylazepane

Systemtic Name: 1-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidin-1-yl]sulfonylazepane Openeye Name: 1-[[4-[2-(3,5-dimethoxyphenyl)ethyl]-1-piperidyl]sulfonyl]azepane CAS Name: 1-[[4-[2-(3,5-dimethoxyphenyl)ethyl]-1-piperidinyl]sulfonyl]azepane IUPAC Name: 1-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidin-1-yl]sulfonylazepane Traditional Name: 1-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidino]sulfonylazepane Formula: C21H34N2O4S MolecularWeight: 410.57066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCC2CCN(CC2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CCC2CCN(CC2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C21H34N2O4S/c1-26-20-15-19(16-21(17-20)27-2)8-7-18-9-13-23(14-10-18)28(24,25)22-11-5-3-4-6-12-22/h15-18H,3-14H2,1-2H3