cyclohexylmethyl 4-(2-cyanoethanoylamino)benzoate

Systemtic Name: cyclohexylmethyl 4-(2-cyanoethanoylamino)benzoate Openeye Name: cyclohexylmethyl 4-[(2-cyanoacetyl)amino]benzoate CAS Name: 4-[(2-cyano-1-oxoethyl)amino]benzoic acid cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl 4-[(2-cyanoacetyl)amino]benzoate Traditional Name: 4-[(2-cyanoacetyl)amino]benzoic acid cyclohexylmethyl ester Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COC(=O)C2=CC=C(C=C2)NC(=O)CC#N

Isomeric SMILES

C1CCC(CC1)COC(=O)C2=CC=C(C=C2)NC(=O)CC#N

InChI

InChI=1S/C17H20N2O3/c18-11-10-16(20)19-15-8-6-14(7-9-15)17(21)22-12-13-4-2-1-3-5-13/h6-9,13H,1-5,10,12H2,(H,19,20)