prop-2-enyl (E)-2-cyano-3-perylen-3-yl-prop-2-enoate

Systemtic Name: prop-2-enyl (E)-2-cyano-3-perylen-3-yl-prop-2-enoate Openeye Name: allyl (E)-2-cyano-3-perylen-3-yl-prop-2-enoate CAS Name: (E)-2-cyano-3-(3-perylenyl)-2-propenoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (E)-2-cyano-3-perylen-3-ylprop-2-enoate Traditional Name: (E)-2-cyano-3-perylen-3-yl-acrylic acid allyl ester Formula: C27H17NO2 MolecularWeight: 387.42938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C(=CC1=CC=C2C3=CC=CC4=C3C(=CC=C4)C5=C2C1=CC=C5)C#N

Isomeric SMILES

C=CCOC(=O)/C(=C/C1=CC=C2C3=CC=CC4=C3C(=CC=C4)C5=C2C1=CC=C5)/C#N

InChI

InChI=1S/C27H17NO2/c1-2-14-30-27(29)19(16-28)15-18-12-13-24-22-10-4-7-17-6-3-9-21(25(17)22)23-11-5-8-20(18)26(23)24/h2-13,15H,1,14H2/b19-15+