3-(4-methylphenyl)chromen-2-one

Systemtic Name: 3-(4-methylphenyl)chromen-2-one Openeye Name: 3-(p-tolyl)chromen-2-one CAS Name: 3-(4-methylphenyl)-1-benzopyran-2-one IUPAC Name: 3-(4-methylphenyl)chromen-2-one Traditional Name: 3-(p-tolyl)coumarin Formula: C16H12O2 MolecularWeight: 236.26528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12O2/c1-11-6-8-12(9-7-11)14-10-13-4-2-3-5-15(13)18-16(14)17/h2-10H,1H3