[1-[(1-cyanocyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 4-propan-2-yloxybenzoate

Systemtic Name: [1-[(1-cyanocyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 4-propan-2-yloxybenzoate Openeye Name: [2-[(1-cyanocyclohexyl)amino]-1-methyl-2-oxo-ethyl] 4-isopropoxybenzoate CAS Name: 4-propan-2-yloxybenzoic acid [1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl] 4-propan-2-yloxybenzoate Traditional Name: 4-isopropoxybenzoic acid [2-[(1-cyanocyclohexyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)OC(C)C(=O)NC2(CCCCC2)C#N

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)OC(C)C(=O)NC2(CCCCC2)C#N

InChI

InChI=1S/C20H26N2O4/c1-14(2)25-17-9-7-16(8-10-17)19(24)26-15(3)18(23)22-20(13-21)11-5-4-6-12-20/h7-10,14-15H,4-6,11-12H2,1-3H3,(H,22,23)