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

Systemtic Name: 1-[[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]methyl]azepane Openeye Name: 1-[[1-(4-ethylphenyl)sulfonyl-4-piperidyl]methyl]azepane CAS Name: 1-[[1-(4-ethylphenyl)sulfonyl-4-piperidinyl]methyl]azepane IUPAC Name: 1-[[1-(4-ethylphenyl)sulfonylpiperidin-4-yl]methyl]azepane Traditional Name: 1-[[1-(4-ethylphenyl)sulfonyl-4-piperidyl]methyl]azepane Formula: C20H32N2O2S MolecularWeight: 364.54528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CN3CCCCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CN3CCCCCC3

InChI

InChI=1S/C20H32N2O2S/c1-2-18-7-9-20(10-8-18)25(23,24)22-15-11-19(12-16-22)17-21-13-5-3-4-6-14-21/h7-10,19H,2-6,11-17H2,1H3