azocan-1-yl-[3-chloranyl-4-(1-methylsulfonylpiperidin-4-yl)oxy-phenyl]methanone

Systemtic Name: azocan-1-yl-[3-chloranyl-4-(1-methylsulfonylpiperidin-4-yl)oxy-phenyl]methanone Openeye Name: azocan-1-yl-[3-chloro-4-[(1-methylsulfonyl-4-piperidyl)oxy]phenyl]methanone CAS Name: 1-azocanyl-[3-chloro-4-[(1-methylsulfonyl-4-piperidinyl)oxy]phenyl]methanone IUPAC Name: azocan-1-yl-[3-chloro-4-(1-methylsulfonylpiperidin-4-yl)oxyphenyl]methanone Traditional Name: azocan-1-yl-[3-chloro-4-[(1-mesyl-4-piperidyl)oxy]phenyl]methanone Formula: C20H29ClN2O4S MolecularWeight: 428.97326

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)OC2=C(C=C(C=C2)C(=O)N3CCCCCCC3)Cl

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)OC2=C(C=C(C=C2)C(=O)N3CCCCCCC3)Cl

InChI

InChI=1S/C20H29ClN2O4S/c1-28(25,26)23-13-9-17(10-14-23)27-19-8-7-16(15-18(19)21)20(24)22-11-5-3-2-4-6-12-22/h7-8,15,17H,2-6,9-14H2,1H3