(E)-3-(4-oxidanylidene-7-phenylmethoxy-8-propyl-chromen-2-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(4-oxidanylidene-7-phenylmethoxy-8-propyl-chromen-2-yl)prop-2-enoic acid Openeye Name: (E)-3-(7-benzyloxy-4-oxo-8-propyl-chromen-2-yl)prop-2-enoic acid CAS Name: (E)-3-(4-oxo-7-phenylmethoxy-8-propyl-1-benzopyran-2-yl)-2-propenoic acid IUPAC Name: (E)-3-(4-oxo-7-phenylmethoxy-8-propylchromen-2-yl)prop-2-enoic acid Traditional Name: (E)-3-(7-benzoxy-4-keto-8-propyl-chromen-2-yl)acrylic acid Formula: C22H20O5 MolecularWeight: 364.3912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC(=CC2=O)C=CC(=O)O)OCC3=CC=CC=C3

Isomeric SMILES

CCCC1=C(C=CC2=C1OC(=CC2=O)/C=C/C(=O)O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H20O5/c1-2-6-18-20(26-14-15-7-4-3-5-8-15)11-10-17-19(23)13-16(27-22(17)18)9-12-21(24)25/h3-5,7-13H,2,6,14H2,1H3,(H,24,25)/b12-9+