3-[(E)-3-(2,5-dimethylphenyl)prop-2-enoyl]chromen-2-one

Systemtic Name: 3-[(E)-3-(2,5-dimethylphenyl)prop-2-enoyl]chromen-2-one Openeye Name: 3-[(E)-3-(2,5-dimethylphenyl)prop-2-enoyl]chromen-2-one CAS Name: 3-[(E)-3-(2,5-dimethylphenyl)-1-oxoprop-2-enyl]-1-benzopyran-2-one IUPAC Name: 3-[(E)-3-(2,5-dimethylphenyl)prop-2-enoyl]chromen-2-one Traditional Name: 3-[(E)-3-(2,5-dimethylphenyl)acryloyl]coumarin Formula: C20H16O3 MolecularWeight: 304.33924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C=CC(=O)C2=CC3=CC=CC=C3OC2=O

Isomeric SMILES

CC1=CC(=C(C=C1)C)/C=C/C(=O)C2=CC3=CC=CC=C3OC2=O

InChI

InChI=1S/C20H16O3/c1-13-7-8-14(2)15(11-13)9-10-18(21)17-12-16-5-3-4-6-19(16)23-20(17)22/h3-12H,1-2H3/b10-9+