3-[3-methyl-1,4-bis(oxidanylidene)naphthalen-2-yl]propanoic acid

Systemtic Name: 3-[3-methyl-1,4-bis(oxidanylidene)naphthalen-2-yl]propanoic acid Openeye Name: 3-(3-methyl-1,4-dioxo-2-naphthyl)propanoic acid CAS Name: 3-(3-methyl-1,4-dioxo-2-naphthalenyl)propanoic acid IUPAC Name: 3-(3-methyl-1,4-dioxonaphthalen-2-yl)propanoic acid Traditional Name: 3-(1,4-diketo-3-methyl-2-naphthyl)propionic acid Formula: C14H12O4 MolecularWeight: 244.24268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=CC=CC=C2C1=O)CCC(=O)O

Isomeric SMILES

CC1=C(C(=O)C2=CC=CC=C2C1=O)CCC(=O)O

InChI

InChI=1S/C14H12O4/c1-8-9(6-7-12(15)16)14(18)11-5-3-2-4-10(11)13(8)17/h2-5H,6-7H2,1H3,(H,15,16)