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

Systemtic Name: [(2R)-1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-3-(3-ethoxy-4-methoxy-phenyl)prop-2-enoate Openeye Name: [(1R)-2-(2-cyanoanilino)-1-methyl-2-oxo-ethyl] (E)-3-(3-ethoxy-4-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-ethoxy-4-methoxyphenyl)-2-propenoic acid [(2R)-1-(2-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-cyanoanilino)-1-oxopropan-2-yl] (E)-3-(3-ethoxy-4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-ethoxy-4-methoxy-phenyl)acrylic acid [(1R)-2-(2-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC(=O)OC(C)C(=O)NC2=CC=CC=C2C#N)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C(=O)O[C@H](C)C(=O)NC2=CC=CC=C2C#N)OC

InChI

InChI=1S/C22H22N2O5/c1-4-28-20-13-16(9-11-19(20)27-3)10-12-21(25)29-15(2)22(26)24-18-8-6-5-7-17(18)14-23/h5-13,15H,4H2,1-3H3,(H,24,26)/b12-10+/t15-/m1/s1