1-hexoxy-4-propan-2-yloxy-naphthalene-2,3-dicarboxylic acid

Systemtic Name: 1-hexoxy-4-propan-2-yloxy-naphthalene-2,3-dicarboxylic acid Openeye Name: 1-hexoxy-4-isopropoxy-naphthalene-2,3-dicarboxylic acid CAS Name: 1-hexoxy-4-propan-2-yloxynaphthalene-2,3-dicarboxylic acid IUPAC Name: 1-hexoxy-4-propan-2-yloxynaphthalene-2,3-dicarboxylic acid Traditional Name: 1-hexoxy-4-isopropoxy-naphthalene-2,3-dicarboxylic acid Formula: C21H26O6 MolecularWeight: 374.42754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C(=C(C2=CC=CC=C21)OC(C)C)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCOC1=C(C(=C(C2=CC=CC=C21)OC(C)C)C(=O)O)C(=O)O

InChI

InChI=1S/C21H26O6/c1-4-5-6-9-12-26-18-14-10-7-8-11-15(14)19(27-13(2)3)17(21(24)25)16(18)20(22)23/h7-8,10-11,13H,4-6,9,12H2,1-3H3,(H,22,23)(H,24,25)