1-[[1-(4-propylphenyl)sulfonylpiperidin-4-yl]methyl]azepane

Systemtic Name: 1-[[1-(4-propylphenyl)sulfonylpiperidin-4-yl]methyl]azepane Openeye Name: 1-[[1-(4-propylphenyl)sulfonyl-4-piperidyl]methyl]azepane CAS Name: 1-[[1-(4-propylphenyl)sulfonyl-4-piperidinyl]methyl]azepane IUPAC Name: 1-[[1-(4-propylphenyl)sulfonylpiperidin-4-yl]methyl]azepane Traditional Name: 1-[[1-(4-propylphenyl)sulfonyl-4-piperidyl]methyl]azepane Formula: C21H34N2O2S MolecularWeight: 378.57186

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CN3CCCCCC3

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CN3CCCCCC3

InChI

InChI=1S/C21H34N2O2S/c1-2-7-19-8-10-21(11-9-19)26(24,25)23-16-12-20(13-17-23)18-22-14-5-3-4-6-15-22/h8-11,20H,2-7,12-18H2,1H3