4-chloranyl-5-cyano-N-[2-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]ethyl]-2-methoxy-benzamide; methanesulfonate

Systemtic Name: 4-chloranyl-5-cyano-N-[2-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]ethyl]-2-methoxy-benzamide; methanesulfonate Openeye Name: 4-chloro-5-cyano-N-[2-[4-(4-fluorobenzoyl)-1-piperidyl]ethyl]-2-methoxy-benzamide; methanesulfonate CAS Name: 4-chloro-5-cyano-N-[2-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]ethyl]-2-methoxybenzamide; methanesulfonate IUPAC Name: 4-chloro-5-cyano-N-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-2-methoxybenzamide; methanesulfonate Traditional Name: 4-chloro-5-cyano-N-[2-[4-(4-fluorobenzoyl)piperidino]ethyl]-2-methoxy-benzamide mesylate Formula: C24H26ClFN3O6S- MolecularWeight: 538.996143

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)Cl)C#N)C(=O)NCCN2CCC(CC2)C(=O)C3=CC=C(C=C3)F.CS(=O)(=O)[O-]

Isomeric SMILES

COC1=C(C=C(C(=C1)Cl)C#N)C(=O)NCCN2CCC(CC2)C(=O)C3=CC=C(C=C3)F.CS(=O)(=O)[O-]

InChI

InChI=1S/C23H23ClFN3O3.CH4O3S/c1-31-21-13-20(24)17(14-26)12-19(21)23(30)27-8-11-28-9-6-16(7-10-28)22(29)15-2-4-18(25)5-3-15;1-5(2,3)4/h2-5,12-13,16H,6-11H2,1H3,(H,27,30);1H3,(H,2,3,4)/p-1