3-tert-butylnaphthalene-1,8-dicarboxylic acid

Systemtic Name: 3-tert-butylnaphthalene-1,8-dicarboxylic acid Openeye Name: 3-tert-butylnaphthalene-1,8-dicarboxylic acid CAS Name: 3-tert-butylnaphthalene-1,8-dicarboxylic acid IUPAC Name: 3-tert-butylnaphthalene-1,8-dicarboxylic acid Traditional Name: 3-tert-butylnaphthalic acid Formula: C16H16O4 MolecularWeight: 272.29584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=C1)C=CC=C2C(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=C1)C=CC=C2C(=O)O)C(=O)O

InChI

InChI=1S/C16H16O4/c1-16(2,3)10-7-9-5-4-6-11(14(17)18)13(9)12(8-10)15(19)20/h4-8H,1-3H3,(H,17,18)(H,19,20)