3-(3-methylbut-2-enoxy)-4-[(E)-3-phenylprop-2-enoyl]xanthen-9-one

Systemtic Name: 3-(3-methylbut-2-enoxy)-4-[(E)-3-phenylprop-2-enoyl]xanthen-9-one Openeye Name: 3-(3-methylbut-2-enoxy)-4-[(E)-3-phenylprop-2-enoyl]xanthen-9-one CAS Name: 3-(3-methylbut-2-enoxy)-4-[(E)-1-oxo-3-phenylprop-2-enyl]-9-xanthenone IUPAC Name: 3-(3-methylbut-2-enoxy)-4-[(E)-3-phenylprop-2-enoyl]xanthen-9-one Traditional Name: 3-(3-methylbut-2-enoxy)-4-[(E)-3-phenylacryloyl]xanthone Formula: C27H22O4 MolecularWeight: 410.46118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3O2)C(=O)C=CC4=CC=CC=C4)C

Isomeric SMILES

CC(=CCOC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3O2)C(=O)/C=C/C4=CC=CC=C4)C

InChI

InChI=1S/C27H22O4/c1-18(2)16-17-30-24-15-13-21-26(29)20-10-6-7-11-23(20)31-27(21)25(24)22(28)14-12-19-8-4-3-5-9-19/h3-16H,17H2,1-2H3/b14-12+