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

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl (E)-2-cyano-3-(2-propoxyphenyl)prop-2-enoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl (E)-2-cyano-3-(2-propoxyphenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(2-propoxyphenyl)-2-propenoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl (E)-2-cyano-3-(2-propoxyphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(2-propoxyphenyl)acrylic acid 2-phthalimidoethyl ester Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C=C(C#N)C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCOC1=CC=CC=C1/C=C(\C#N)/C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C23H20N2O5/c1-2-12-29-20-10-6-3-7-16(20)14-17(15-24)23(28)30-13-11-25-21(26)18-8-4-5-9-19(18)22(25)27/h3-10,14H,2,11-13H2,1H3/b17-14+