methyl 1-[[1-(5-chloranyl-2-methoxy-phenyl)carbonylpiperidin-4-yl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[1-(5-chloranyl-2-methoxy-phenyl)carbonylpiperidin-4-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[1-(5-chloro-2-methoxy-benzoyl)piperidine-4-carbonyl]amino]cyclohexanecarboxylate CAS Name: 1-[[[1-[(5-chloro-2-methoxyphenyl)-oxomethyl]-4-piperidinyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[1-(5-chloro-2-methoxybenzoyl)piperidine-4-carbonyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[1-(5-chloro-2-methoxy-benzoyl)isonipecotoyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C22H29ClN2O5 MolecularWeight: 436.92906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)N2CCC(CC2)C(=O)NC3(CCCCC3)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)N2CCC(CC2)C(=O)NC3(CCCCC3)C(=O)OC

InChI

InChI=1S/C22H29ClN2O5/c1-29-18-7-6-16(23)14-17(18)20(27)25-12-8-15(9-13-25)19(26)24-22(21(28)30-2)10-4-3-5-11-22/h6-7,14-15H,3-5,8-13H2,1-2H3,(H,24,26)