2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl (E)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl (E)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl (E)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(4-hexoxy-3-methoxyphenyl)-2-propenoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl (E)-3-(4-hexoxy-3-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-hexoxy-3-methoxy-phenyl)acrylic acid 2-phthalimidoethyl ester Formula: C26H29NO6 MolecularWeight: 451.51156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=CC(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=C/C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)OC

InChI

InChI=1S/C26H29NO6/c1-3-4-5-8-16-32-22-13-11-19(18-23(22)31-2)12-14-24(28)33-17-15-27-25(29)20-9-6-7-10-21(20)26(27)30/h6-7,9-14,18H,3-5,8,15-17H2,1-2H3/b14-12+