3-(2,5-dimethylphenyl)-4-prop-2-enoxy-isochromen-1-one

Systemtic Name: 3-(2,5-dimethylphenyl)-4-prop-2-enoxy-isochromen-1-one Openeye Name: 4-allyloxy-3-(2,5-dimethylphenyl)isochromen-1-one CAS Name: 3-(2,5-dimethylphenyl)-4-prop-2-enoxy-2-benzopyran-1-one IUPAC Name: 3-(2,5-dimethylphenyl)-4-prop-2-enoxyisochromen-1-one Traditional Name: 4-allyloxy-3-(2,5-dimethylphenyl)isocoumarin Formula: C20H18O3 MolecularWeight: 306.35512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=C(C3=CC=CC=C3C(=O)O2)OCC=C

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=C(C3=CC=CC=C3C(=O)O2)OCC=C

InChI

InChI=1S/C20H18O3/c1-4-11-22-18-15-7-5-6-8-16(15)20(21)23-19(18)17-12-13(2)9-10-14(17)3/h4-10,12H,1,11H2,2-3H3