[(2R)-1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-3-(3-ethoxy-4-propoxy-phenyl)prop-2-enoate

Systemtic Name: [(2R)-1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-3-(3-ethoxy-4-propoxy-phenyl)prop-2-enoate Openeye Name: [(1R)-2-(3-cyanoanilino)-1-methyl-2-oxo-ethyl] (E)-3-(3-ethoxy-4-propoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-ethoxy-4-propoxyphenyl)-2-propenoic acid [(2R)-1-(3-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(3-cyanoanilino)-1-oxopropan-2-yl] (E)-3-(3-ethoxy-4-propoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-ethoxy-4-propoxy-phenyl)acrylic acid [(1R)-2-(3-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC(=O)OC(C)C(=O)NC2=CC=CC(=C2)C#N)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C(=O)O[C@H](C)C(=O)NC2=CC=CC(=C2)C#N)OCC

InChI

InChI=1S/C24H26N2O5/c1-4-13-30-21-11-9-18(15-22(21)29-5-2)10-12-23(27)31-17(3)24(28)26-20-8-6-7-19(14-20)16-25/h6-12,14-15,17H,4-5,13H2,1-3H3,(H,26,28)/b12-10+/t17-/m1/s1