methyl hexahelicene-3-carboxylate

Systemtic Name: methyl hexahelicene-3-carboxylate Openeye Name: methyl hexahelicene-3-carboxylate CAS Name: 3-hexahelicenecarboxylic acid methyl ester IUPAC Name: methyl hexahelicene-3-carboxylate Traditional Name: hexahelicene-3-carboxylic acid methyl ester Formula: C28H18O2 MolecularWeight: 386.44132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C3=C(C=CC4=C3C5=C(C=C4)C=CC6=CC=CC=C65)C=C2

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C3=C(C=CC4=C3C5=C(C=C4)C=CC6=CC=CC=C65)C=C2

InChI

InChI=1S/C28H18O2/c1-30-28(29)22-14-15-24-21(16-22)13-12-19-9-11-20-10-8-18-7-6-17-4-2-3-5-23(17)25(18)27(20)26(19)24/h2-16H,1H3