3,4-diethyl-7-[(E)-3-phenylprop-2-enoyl]chromen-2-one

Systemtic Name: 3,4-diethyl-7-[(E)-3-phenylprop-2-enoyl]chromen-2-one Openeye Name: 3,4-diethyl-7-[(E)-3-phenylprop-2-enoyl]chromen-2-one CAS Name: 3,4-diethyl-7-[(E)-1-oxo-3-phenylprop-2-enyl]-1-benzopyran-2-one IUPAC Name: 3,4-diethyl-7-[(E)-3-phenylprop-2-enoyl]chromen-2-one Traditional Name: 3,4-diethyl-7-[(E)-3-phenylacryloyl]coumarin Formula: C22H20O3 MolecularWeight: 332.3924

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)OC2=C1C=CC(=C2)C(=O)C=CC3=CC=CC=C3)CC

Isomeric SMILES

CCC1=C(C(=O)OC2=C1C=CC(=C2)C(=O)/C=C/C3=CC=CC=C3)CC

InChI

InChI=1S/C22H20O3/c1-3-17-18(4-2)22(24)25-21-14-16(11-12-19(17)21)20(23)13-10-15-8-6-5-7-9-15/h5-14H,3-4H2,1-2H3/b13-10+