3-(4-methoxyphenyl)carbonyl-4-methyl-isochromen-1-one

Systemtic Name: 3-(4-methoxyphenyl)carbonyl-4-methyl-isochromen-1-one Openeye Name: 3-(4-methoxybenzoyl)-4-methyl-isochromen-1-one CAS Name: 3-[(4-methoxyphenyl)-oxomethyl]-4-methyl-2-benzopyran-1-one IUPAC Name: 3-(4-methoxybenzoyl)-4-methylisochromen-1-one Traditional Name: 4-methyl-3-p-anisoyl-isocoumarin Formula: C18H14O4 MolecularWeight: 294.30136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=O)C2=CC=CC=C12)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(OC(=O)C2=CC=CC=C12)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H14O4/c1-11-14-5-3-4-6-15(14)18(20)22-17(11)16(19)12-7-9-13(21-2)10-8-12/h3-10H,1-2H3