2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl (E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl (E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl (E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-dimethylaminophenyl)-2-propenoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl (E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(4-dimethylaminophenyl)acrylic acid 2-phthalimidoethyl ester Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=C(C#N)C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C(\C#N)/C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C22H19N3O4/c1-24(2)17-9-7-15(8-10-17)13-16(14-23)22(28)29-12-11-25-20(26)18-5-3-4-6-19(18)21(25)27/h3-10,13H,11-12H2,1-2H3/b16-13+