methyl 3-[(2-cyclohexylethanoylamino)methyl]-5-(furan-2-ylcarbonylamino)benzoate

Systemtic Name: methyl 3-[(2-cyclohexylethanoylamino)methyl]-5-(furan-2-ylcarbonylamino)benzoate Openeye Name: methyl 3-[[(2-cyclohexylacetyl)amino]methyl]-5-(furan-2-carbonylamino)benzoate CAS Name: 3-[[(2-cyclohexyl-1-oxoethyl)amino]methyl]-5-[[2-furanyl(oxo)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[(2-cyclohexylacetyl)amino]methyl]-5-(furan-2-carbonylamino)benzoate Traditional Name: 3-[[(2-cyclohexylacetyl)amino]methyl]-5-(2-furoylamino)benzoic acid methyl ester Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC=CO2)CNC(=O)CC3CCCCC3

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC=CO2)CNC(=O)CC3CCCCC3

InChI

InChI=1S/C22H26N2O5/c1-28-22(27)17-10-16(14-23-20(25)12-15-6-3-2-4-7-15)11-18(13-17)24-21(26)19-8-5-9-29-19/h5,8-11,13,15H,2-4,6-7,12,14H2,1H3,(H,23,25)(H,24,26)