4-methyl-4-(3-phenylpropyl)isochromene-1,3-dione

Systemtic Name: 4-methyl-4-(3-phenylpropyl)isochromene-1,3-dione Openeye Name: 4-methyl-4-(3-phenylpropyl)isochromane-1,3-dione CAS Name: 4-methyl-4-(3-phenylpropyl)-3,4-dihydro-1H-2-benzopyran-1,3-dione IUPAC Name: 4-methyl-4-(3-phenylpropyl)isochromene-1,3-dione Traditional Name: 4-methyl-4-(3-phenylpropyl)isochroman-1,3-quinone Formula: C19H18O3 MolecularWeight: 294.34442

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2C(=O)OC1=O)CCCC3=CC=CC=C3

Isomeric SMILES

CC1(C2=CC=CC=C2C(=O)OC1=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C19H18O3/c1-19(13-7-10-14-8-3-2-4-9-14)16-12-6-5-11-15(16)17(20)22-18(19)21/h2-6,8-9,11-12H,7,10,13H2,1H3