5-[3-methyl-1,4-bis(oxidanylidene)naphthalen-2-yl]pentanoic acid

Systemtic Name: 5-[3-methyl-1,4-bis(oxidanylidene)naphthalen-2-yl]pentanoic acid Openeye Name: 5-(3-methyl-1,4-dioxo-2-naphthyl)pentanoic acid CAS Name: 5-(3-methyl-1,4-dioxo-2-naphthalenyl)pentanoic acid IUPAC Name: 5-(3-methyl-1,4-dioxonaphthalen-2-yl)pentanoic acid Traditional Name: 5-(1,4-diketo-3-methyl-2-naphthyl)valeric acid Formula: C16H16O4 MolecularWeight: 272.29584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16O4/c1-10-11(6-4-5-9-14(17)18)16(20)13-8-3-2-7-12(13)15(10)19/h2-3,7-8H,4-6,9H2,1H3,(H,17,18)