methyl 3-cyano-2-[2-(diethylamino)ethanoylamino]-4,5-dimethyl-benzoate

Systemtic Name: methyl 3-cyano-2-[2-(diethylamino)ethanoylamino]-4,5-dimethyl-benzoate Openeye Name: methyl 3-cyano-2-[[2-(diethylamino)acetyl]amino]-4,5-dimethyl-benzoate CAS Name: 3-cyano-2-[[2-(diethylamino)-1-oxoethyl]amino]-4,5-dimethylbenzoic acid methyl ester IUPAC Name: methyl 3-cyano-2-[[2-(diethylamino)acetyl]amino]-4,5-dimethylbenzoate Traditional Name: 3-cyano-2-[[2-(diethylamino)acetyl]amino]-4,5-dimethyl-benzoic acid methyl ester Formula: C17H23N3O3 MolecularWeight: 317.38282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(=O)NC1=C(C(=C(C=C1C(=O)OC)C)C)C#N

Isomeric SMILES

CCN(CC)CC(=O)NC1=C(C(=C(C=C1C(=O)OC)C)C)C#N

InChI

InChI=1S/C17H23N3O3/c1-6-20(7-2)10-15(21)19-16-13(17(22)23-5)8-11(3)12(4)14(16)9-18/h8H,6-7,10H2,1-5H3,(H,19,21)