4-[(2-cyclohexylethanoylamino)methyl]benzoate

Systemtic Name: 4-[(2-cyclohexylethanoylamino)methyl]benzoate Openeye Name: 4-[[(2-cyclohexylacetyl)amino]methyl]benzoate CAS Name: 4-[[(2-cyclohexyl-1-oxoethyl)amino]methyl]benzoate IUPAC Name: 4-[[(2-cyclohexylacetyl)amino]methyl]benzoate Traditional Name: 4-[[(2-cyclohexylacetyl)amino]methyl]benzoate Formula: C16H20NO3- MolecularWeight: 274.3349

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(=O)NCC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

C1CCC(CC1)CC(=O)NCC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C16H21NO3/c18-15(10-12-4-2-1-3-5-12)17-11-13-6-8-14(9-7-13)16(19)20/h6-9,12H,1-5,10-11H2,(H,17,18)(H,19,20)/p-1