methyl 4-[(E)-3-[2-[(1-cyanocyclohexyl)-methyl-amino]-2-oxidanylidene-ethoxy]-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-[2-[(1-cyanocyclohexyl)-methyl-amino]-2-oxidanylidene-ethoxy]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-[2-[(1-cyanocyclohexyl)-methyl-amino]-2-oxo-ethoxy]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethoxy]-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethoxy]-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-[2-[(1-cyanocyclohexyl)-methyl-amino]-2-keto-ethoxy]-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C21H24N2O5 MolecularWeight: 384.42566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)COC(=O)C=CC1=CC=C(C=C1)C(=O)OC)C2(CCCCC2)C#N

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O5/c1-23(21(15-22)12-4-3-5-13-21)18(24)14-28-19(25)11-8-16-6-9-17(10-7-16)20(26)27-2/h6-11H,3-5,12-14H2,1-2H3/b11-8+