3-cyclopropyl-7-methyl-7-oxidanyl-isochromene-6,8-dione

Systemtic Name: 3-cyclopropyl-7-methyl-7-oxidanyl-isochromene-6,8-dione Openeye Name: 3-cyclopropyl-7-hydroxy-7-methyl-isochromene-6,8-dione CAS Name: 3-cyclopropyl-7-hydroxy-7-methyl-2-benzopyran-6,8-dione IUPAC Name: 3-cyclopropyl-7-hydroxy-7-methylisochromene-6,8-dione Traditional Name: 3-cyclopropyl-7-hydroxy-7-methyl-isochromene-6,8-quinone Formula: C13H12O4 MolecularWeight: 232.23198

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C=C2C=C(OC=C2C1=O)C3CC3)O

Isomeric SMILES

CC1(C(=O)C=C2C=C(OC=C2C1=O)C3CC3)O

InChI

InChI=1S/C13H12O4/c1-13(16)11(14)5-8-4-10(7-2-3-7)17-6-9(8)12(13)15/h4-7,16H,2-3H2,1H3