3-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl]chromen-2-one

Systemtic Name: 3-[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl]chromen-2-one Openeye Name: 3-[2-(3,4-dimethylphenyl)-2-oxo-ethyl]chromen-2-one CAS Name: 3-[2-(3,4-dimethylphenyl)-2-oxoethyl]-1-benzopyran-2-one IUPAC Name: 3-[2-(3,4-dimethylphenyl)-2-oxoethyl]chromen-2-one Traditional Name: 3-[2-(3,4-dimethylphenyl)-2-keto-ethyl]coumarin Formula: C19H16O3 MolecularWeight: 292.32854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CC2=CC3=CC=CC=C3OC2=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CC2=CC3=CC=CC=C3OC2=O)C

InChI

InChI=1S/C19H16O3/c1-12-7-8-14(9-13(12)2)17(20)11-16-10-15-5-3-4-6-18(15)22-19(16)21/h3-10H,11H2,1-2H3