[2-[(1-cyanocyclohexyl)-methyl-amino]-2-oxidanylidene-ethyl] 3-(4-methoxyphenyl)propanoate

Systemtic Name: [2-[(1-cyanocyclohexyl)-methyl-amino]-2-oxidanylidene-ethyl] 3-(4-methoxyphenyl)propanoate Openeye Name: [2-[(1-cyanocyclohexyl)-methyl-amino]-2-oxo-ethyl] 3-(4-methoxyphenyl)propanoate CAS Name: 3-(4-methoxyphenyl)propanoic acid [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 3-(4-methoxyphenyl)propanoate Traditional Name: 3-(4-methoxyphenyl)propionic acid [2-[(1-cyanocyclohexyl)-methyl-amino]-2-keto-ethyl] ester Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)COC(=O)CCC1=CC=C(C=C1)OC)C2(CCCCC2)C#N

Isomeric SMILES

CN(C(=O)COC(=O)CCC1=CC=C(C=C1)OC)C2(CCCCC2)C#N

InChI

InChI=1S/C20H26N2O4/c1-22(20(15-21)12-4-3-5-13-20)18(23)14-26-19(24)11-8-16-6-9-17(25-2)10-7-16/h6-7,9-10H,3-5,8,11-14H2,1-2H3