methyl 4-[(4-chloranylbutanoylamino)methyl]cyclohexane-1-carboxylate

Systemtic Name: methyl 4-[(4-chloranylbutanoylamino)methyl]cyclohexane-1-carboxylate Openeye Name: methyl 4-[(4-chlorobutanoylamino)methyl]cyclohexanecarboxylate CAS Name: 4-[[(4-chloro-1-oxobutyl)amino]methyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-[(4-chlorobutanoylamino)methyl]cyclohexane-1-carboxylate Traditional Name: 4-[(4-chlorobutanoylamino)methyl]cyclohexanecarboxylic acid methyl ester Formula: C13H22ClNO3 MolecularWeight: 275.77168

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(CC1)CNC(=O)CCCCl

Isomeric SMILES

COC(=O)C1CCC(CC1)CNC(=O)CCCCl

InChI

InChI=1S/C13H22ClNO3/c1-18-13(17)11-6-4-10(5-7-11)9-15-12(16)3-2-8-14/h10-11H,2-9H2,1H3,(H,15,16)