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

Systemtic Name: 2-[2-methyl-4-[3-methyl-1,4-bis(oxidanylidene)naphthalen-2-yl]butyl]propanedioic acid Openeye Name: 2-[2-methyl-4-(3-methyl-1,4-dioxo-2-naphthyl)butyl]propanedioic acid CAS Name: 2-[2-methyl-4-(3-methyl-1,4-dioxo-2-naphthalenyl)butyl]propanedioic acid IUPAC Name: 2-[2-methyl-4-(3-methyl-1,4-dioxonaphthalen-2-yl)butyl]propanedioic acid Traditional Name: 2-[4-(1,4-diketo-3-methyl-2-naphthyl)-2-methyl-butyl]malonic acid Formula: C19H20O6 MolecularWeight: 344.3585

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20O6/c1-10(9-15(18(22)23)19(24)25)7-8-12-11(2)16(20)13-5-3-4-6-14(13)17(12)21/h3-6,10,15H,7-9H2,1-2H3,(H,22,23)(H,24,25)