1-methoxy-4,4-dimethyl-1-phenyl-isochromen-3-one

Systemtic Name: 1-methoxy-4,4-dimethyl-1-phenyl-isochromen-3-one Openeye Name: 1-methoxy-4,4-dimethyl-1-phenyl-isochroman-3-one CAS Name: 1-methoxy-4,4-dimethyl-1-phenyl-3,4-dihydro-1H-2-benzopyran-3-one IUPAC Name: 1-methoxy-4,4-dimethyl-1-phenylisochromen-3-one Traditional Name: 1-methoxy-4,4-dimethyl-1-phenyl-isochroman-3-one Formula: C18H18O3 MolecularWeight: 282.33372

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2C(OC1=O)(C3=CC=CC=C3)OC)C

Isomeric SMILES

CC1(C2=CC=CC=C2C(OC1=O)(C3=CC=CC=C3)OC)C

InChI

InChI=1S/C18H18O3/c1-17(2)14-11-7-8-12-15(14)18(20-3,21-16(17)19)13-9-5-4-6-10-13/h4-12H,1-3H3