5-methoxy-3,4-dimethyl-7-(4-propan-2-ylphenyl)chromen-2-one

Systemtic Name: 5-methoxy-3,4-dimethyl-7-(4-propan-2-ylphenyl)chromen-2-one Openeye Name: 7-(4-isopropylphenyl)-5-methoxy-3,4-dimethyl-chromen-2-one CAS Name: 5-methoxy-3,4-dimethyl-7-(4-propan-2-ylphenyl)-1-benzopyran-2-one IUPAC Name: 5-methoxy-3,4-dimethyl-7-(4-propan-2-ylphenyl)chromen-2-one Traditional Name: 5-methoxy-3,4-dimethyl-7-p-cumenyl-coumarin Formula: C21H22O3 MolecularWeight: 322.39758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C(=CC(=C2)C3=CC=C(C=C3)C(C)C)OC)C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C(=CC(=C2)C3=CC=C(C=C3)C(C)C)OC)C

InChI

InChI=1S/C21H22O3/c1-12(2)15-6-8-16(9-7-15)17-10-18(23-5)20-13(3)14(4)21(22)24-19(20)11-17/h6-12H,1-5H3