1-[1-(3-chloranyl-4-methyl-phenyl)sulfonylpiperidin-4-yl]azepane

Systemtic Name: 1-[1-(3-chloranyl-4-methyl-phenyl)sulfonylpiperidin-4-yl]azepane Openeye Name: 1-[1-(3-chloro-4-methyl-phenyl)sulfonyl-4-piperidyl]azepane CAS Name: 1-[1-(3-chloro-4-methylphenyl)sulfonyl-4-piperidinyl]azepane IUPAC Name: 1-[1-(3-chloro-4-methylphenyl)sulfonylpiperidin-4-yl]azepane Traditional Name: 1-[1-(3-chloro-4-methyl-phenyl)sulfonyl-4-piperidyl]azepane Formula: C18H27ClN2O2S MolecularWeight: 370.93718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)N3CCCCCC3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)N3CCCCCC3)Cl

InChI

InChI=1S/C18H27ClN2O2S/c1-15-6-7-17(14-18(15)19)24(22,23)21-12-8-16(9-13-21)20-10-4-2-3-5-11-20/h6-7,14,16H,2-5,8-13H2,1H3