[1-[(1-cyanocyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 2-phenoxyethanoate

Systemtic Name: [1-[(1-cyanocyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 2-phenoxyethanoate Openeye Name: [2-[(1-cyanocyclohexyl)amino]-1-methyl-2-oxo-ethyl] 2-phenoxyacetate CAS Name: 2-phenoxyacetic acid [1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl] 2-phenoxyacetate Traditional Name: 2-phenoxyacetic acid [2-[(1-cyanocyclohexyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C18H22N2O4 MolecularWeight: 330.37828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1(CCCCC1)C#N)OC(=O)COC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC1(CCCCC1)C#N)OC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C18H22N2O4/c1-14(17(22)20-18(13-19)10-6-3-7-11-18)24-16(21)12-23-15-8-4-2-5-9-15/h2,4-5,8-9,14H,3,6-7,10-12H2,1H3,(H,20,22)