methyl 5-[(4-cyclohexylbutanoylamino)methyl]-2-methoxy-benzoate

Systemtic Name: methyl 5-[(4-cyclohexylbutanoylamino)methyl]-2-methoxy-benzoate Openeye Name: methyl 5-[(4-cyclohexylbutanoylamino)methyl]-2-methoxy-benzoate CAS Name: 5-[[(4-cyclohexyl-1-oxobutyl)amino]methyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-[(4-cyclohexylbutanoylamino)methyl]-2-methoxybenzoate Traditional Name: 5-[(4-cyclohexylbutanoylamino)methyl]-2-methoxy-benzoic acid methyl ester Formula: C20H29NO4 MolecularWeight: 347.44856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CCCC2CCCCC2)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CCCC2CCCCC2)C(=O)OC

InChI

InChI=1S/C20H29NO4/c1-24-18-12-11-16(13-17(18)20(23)25-2)14-21-19(22)10-6-9-15-7-4-3-5-8-15/h11-13,15H,3-10,14H2,1-2H3,(H,21,22)