[2-(dicyclohexylamino)-2-oxidanylidene-ethyl] (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate

Systemtic Name: [2-(dicyclohexylamino)-2-oxidanylidene-ethyl] (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate Openeye Name: [2-(dicyclohexylamino)-2-oxo-ethyl] (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(cyanomethoxy)phenyl]-2-propenoic acid [2-(dicyclohexylamino)-2-oxoethyl] ester IUPAC Name: [2-(dicyclohexylamino)-2-oxoethyl] (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(cyanomethoxy)phenyl]acrylic acid [2-(dicyclohexylamino)-2-keto-ethyl] ester Formula: C25H32N2O4 MolecularWeight: 424.53258

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2CCCCC2)C(=O)COC(=O)C=CC3=CC=C(C=C3)OCC#N

Isomeric SMILES

C1CCC(CC1)N(C2CCCCC2)C(=O)COC(=O)/C=C/C3=CC=C(C=C3)OCC#N

InChI

InChI=1S/C25H32N2O4/c26-17-18-30-23-14-11-20(12-15-23)13-16-25(29)31-19-24(28)27(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h11-16,21-22H,1-10,18-19H2/b16-13+