5-(3-methyl-4-oxidanylidene-chromen-2-yl)-1,3-benzodioxole-2-carboxylic acid

Systemtic Name: 5-(3-methyl-4-oxidanylidene-chromen-2-yl)-1,3-benzodioxole-2-carboxylic acid Openeye Name: 5-(3-methyl-4-oxo-chromen-2-yl)-1,3-benzodioxole-2-carboxylic acid CAS Name: 5-(3-methyl-4-oxo-1-benzopyran-2-yl)-1,3-benzodioxole-2-carboxylic acid IUPAC Name: 5-(3-methyl-4-oxochromen-2-yl)-1,3-benzodioxole-2-carboxylic acid Traditional Name: 5-(4-keto-3-methyl-chromen-2-yl)-1,3-benzodioxole-2-carboxylic acid Formula: C18H12O6 MolecularWeight: 324.28428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C2C1=O)C3=CC4=C(C=C3)OC(O4)C(=O)O

Isomeric SMILES

CC1=C(OC2=CC=CC=C2C1=O)C3=CC4=C(C=C3)OC(O4)C(=O)O

InChI

InChI=1S/C18H12O6/c1-9-15(19)11-4-2-3-5-12(11)22-16(9)10-6-7-13-14(8-10)24-18(23-13)17(20)21/h2-8,18H,1H3,(H,20,21)