6-propoxycarbonylbenzene-1,2,3,4,5-pentacarboxylic acid

Systemtic Name: 6-propoxycarbonylbenzene-1,2,3,4,5-pentacarboxylic acid Openeye Name: 6-propoxycarbonylbenzene-1,2,3,4,5-pentacarboxylic acid CAS Name: 6-[oxo(propoxy)methyl]benzene-1,2,3,4,5-pentacarboxylic acid IUPAC Name: 6-propoxycarbonylbenzene-1,2,3,4,5-pentacarboxylic acid Traditional Name: 6-propoxycarbonylbenzene-1,2,3,4,5-pentacarboxylic acid Formula: C15H12O12 MolecularWeight: 384.24858

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(C(=C(C(=C1C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

CCCOC(=O)C1=C(C(=C(C(=C1C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C15H12O12/c1-2-3-27-15(26)9-7(13(22)23)5(11(18)19)4(10(16)17)6(12(20)21)8(9)14(24)25/h2-3H2,1H3,(H,16,17)(H,18,19)(H,20,21)(H,22,23)(H,24,25)