methyl 4-[2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 4-[2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 4-[2-[(1-cyanocyclohexyl)amino]-2-oxo-ethoxy]benzoate CAS Name: 4-[2-[(1-cyanocyclohexyl)amino]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(1-cyanocyclohexyl)amino]-2-oxoethoxy]benzoate Traditional Name: 4-[2-[(1-cyanocyclohexyl)amino]-2-keto-ethoxy]benzoic acid methyl ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC(=O)NC2(CCCCC2)C#N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC(=O)NC2(CCCCC2)C#N

InChI

InChI=1S/C17H20N2O4/c1-22-16(21)13-5-7-14(8-6-13)23-11-15(20)19-17(12-18)9-3-2-4-10-17/h5-8H,2-4,9-11H2,1H3,(H,19,20)