(2Z)-9-(4-oxidanylidene-8-propyl-2,3-dihydrochromen-7-yl)-2-(phenylmethylidene)nona-3,8-diynoic acid

Systemtic Name: (2Z)-9-(4-oxidanylidene-8-propyl-2,3-dihydrochromen-7-yl)-2-(phenylmethylidene)nona-3,8-diynoic acid Openeye Name: (2Z)-2-benzylidene-9-(4-oxo-8-propyl-chroman-7-yl)nona-3,8-diynoic acid CAS Name: (2Z)-9-(4-oxo-8-propyl-3,4-dihydro-2H-1-benzopyran-7-yl)-2-(phenylmethylene)nona-3,8-diynoic acid IUPAC Name: (2Z)-2-benzylidene-9-(4-oxo-8-propyl-2,3-dihydrochromen-7-yl)nona-3,8-diynoic acid Traditional Name: (2Z)-2-benzal-9-(4-keto-8-propyl-chroman-7-yl)nona-3,8-diynoic acid Formula: C28H26O4 MolecularWeight: 426.50364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OCCC2=O)C#CCCCC#CC(=CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCC1=C(C=CC2=C1OCCC2=O)C#CCCCC#C/C(=C/C3=CC=CC=C3)/C(=O)O

InChI

InChI=1S/C28H26O4/c1-2-11-24-22(16-17-25-26(29)18-19-32-27(24)25)14-9-4-3-5-10-15-23(28(30)31)20-21-12-7-6-8-13-21/h6-8,12-13,16-17,20H,2-5,11,18-19H2,1H3,(H,30,31)/b23-20-