3-[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]chromen-2-one

Systemtic Name: 3-[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]chromen-2-one Openeye Name: 3-[(E)-3-(4-isopropylphenyl)prop-2-enoyl]chromen-2-one CAS Name: 3-[(E)-1-oxo-3-(4-propan-2-ylphenyl)prop-2-enyl]-1-benzopyran-2-one IUPAC Name: 3-[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]chromen-2-one Traditional Name: 3-[(E)-3-p-cumenylacryloyl]coumarin Formula: C21H18O3 MolecularWeight: 318.36582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18O3/c1-14(2)16-10-7-15(8-11-16)9-12-19(22)18-13-17-5-3-4-6-20(17)24-21(18)23/h3-14H,1-2H3/b12-9+