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3-methyl-1-oxidanylidene-6-propan-2-yl-isochromene-5-carboxylic acid

3-methyl-1-oxidanylidene-6-propan-2-yl-isochromene-5-carboxylic acid

Systemtic Name:3-methyl-1-oxidanylidene-6-propan-2-yl-isochromene-5-carboxylic acid
Openeye Name:6-isopropyl-3-methyl-1-oxo-isochromene-5-carboxylic acid
CAS Name:3-methyl-1-oxo-6-propan-2-yl-2-benzopyran-5-carboxylic acid
IUPAC Name:3-methyl-1-oxo-6-propan-2-ylisochromene-5-carboxylic acid
Traditional Name:6-isopropyl-1-keto-3-methyl-isochromene-5-carboxylic acid
Formula: C14H14O4
MolecularWeight: 246.25856
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC(=C2C(=O)O)C(C)C)C(=O)O1


Isomeric SMILES

CC1=CC2=C(C=CC(=C2C(=O)O)C(C)C)C(=O)O1


InChI

InChI=1S/C14H14O4/c1-7(2)9-4-5-10-11(12(9)13(15)16)6-8(3)18-14(10)17/h4-7H,1-3H3,(H,15,16)


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