2-(4-hydroxyphenyl)-5-methoxy-8-(3-methylbut-2-enyl)-4-oxidanylidene-2,3-dihydrochromen-7-olate

Systemtic Name: 2-(4-hydroxyphenyl)-5-methoxy-8-(3-methylbut-2-enyl)-4-oxidanylidene-2,3-dihydrochromen-7-olate Openeye Name: 2-(4-hydroxyphenyl)-5-methoxy-8-(3-methylbut-2-enyl)-4-oxo-chroman-7-olate CAS Name: 2-(4-hydroxyphenyl)-5-methoxy-8-(3-methylbut-2-enyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-7-olate IUPAC Name: 2-(4-hydroxyphenyl)-5-methoxy-8-(3-methylbut-2-enyl)-4-oxo-2,3-dihydrochromen-7-olate Traditional Name: 2-(4-hydroxyphenyl)-4-keto-5-methoxy-8-(3-methylbut-2-enyl)chroman-7-olate Formula: C21H21O5- MolecularWeight: 353.38844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=C2C(=C(C=C1[O-])OC)C(=O)CC(O2)C3=CC=C(C=C3)O)C

Isomeric SMILES

CC(=CCC1=C2C(=C(C=C1[O-])OC)C(=O)CC(O2)C3=CC=C(C=C3)O)C

InChI

InChI=1S/C21H22O5/c1-12(2)4-9-15-16(23)10-19(25-3)20-17(24)11-18(26-21(15)20)13-5-7-14(22)8-6-13/h4-8,10,18,22-23H,9,11H2,1-3H3/p-1