methyl 2-[[2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl]amino]-6-methyl-benzoate

Systemtic Name: methyl 2-[[2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl]amino]-6-methyl-benzoate Openeye Name: methyl 2-[[2-[(1-cyanocyclohexyl)amino]-2-oxo-ethyl]amino]-6-methyl-benzoate CAS Name: 2-[[2-[(1-cyanocyclohexyl)amino]-2-oxoethyl]amino]-6-methylbenzoic acid methyl ester IUPAC Name: methyl 2-[[2-[(1-cyanocyclohexyl)amino]-2-oxoethyl]amino]-6-methylbenzoate Traditional Name: 2-[[2-[(1-cyanocyclohexyl)amino]-2-keto-ethyl]amino]-6-methyl-benzoic acid methyl ester Formula: C18H23N3O3 MolecularWeight: 329.39352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NCC(=O)NC2(CCCCC2)C#N)C(=O)OC

Isomeric SMILES

CC1=C(C(=CC=C1)NCC(=O)NC2(CCCCC2)C#N)C(=O)OC

InChI

InChI=1S/C18H23N3O3/c1-13-7-6-8-14(16(13)17(23)24-2)20-11-15(22)21-18(12-19)9-4-3-5-10-18/h6-8,20H,3-5,9-11H2,1-2H3,(H,21,22)