[1-[(2-cyano-3-methyl-butan-2-yl)amino]-1-oxidanylidene-propan-2-yl] 2-phenoxypropanoate

Systemtic Name: [1-[(2-cyano-3-methyl-butan-2-yl)amino]-1-oxidanylidene-propan-2-yl] 2-phenoxypropanoate Openeye Name: [2-[(1-cyano-1,2-dimethyl-propyl)amino]-1-methyl-2-oxo-ethyl] 2-phenoxypropanoate CAS Name: 2-phenoxypropanoic acid [1-[(2-cyano-3-methylbutan-2-yl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(2-cyano-3-methylbutan-2-yl)amino]-1-oxopropan-2-yl] 2-phenoxypropanoate Traditional Name: 2-phenoxypropionic acid [2-[(1-cyano-1,2-dimethyl-propyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C18H24N2O4 MolecularWeight: 332.39416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)C(C)OC(=O)C(C)OC1=CC=CC=C1

Isomeric SMILES

CC(C)C(C)(C#N)NC(=O)C(C)OC(=O)C(C)OC1=CC=CC=C1

InChI

InChI=1S/C18H24N2O4/c1-12(2)18(5,11-19)20-16(21)13(3)24-17(22)14(4)23-15-9-7-6-8-10-15/h6-10,12-14H,1-5H3,(H,20,21)