4-[5-(3-carboxy-4-oxidanyl-naphthalen-1-yl)-5-oxidanylidene-pentanoyl]-1-oxidanyl-naphthalene-2-carboxylic acid

Systemtic Name: 4-[5-(3-carboxy-4-oxidanyl-naphthalen-1-yl)-5-oxidanylidene-pentanoyl]-1-oxidanyl-naphthalene-2-carboxylic acid Openeye Name: 4-[5-(3-carboxy-4-hydroxy-1-naphthyl)-5-oxo-pentanoyl]-1-hydroxy-naphthalene-2-carboxylic acid CAS Name: 4-[5-(3-carboxy-4-hydroxy-1-naphthalenyl)-1,5-dioxopentyl]-1-hydroxy-2-naphthalenecarboxylic acid IUPAC Name: 4-[5-(3-carboxy-4-hydroxynaphthalen-1-yl)-5-oxopentanoyl]-1-hydroxynaphthalene-2-carboxylic acid Traditional Name: 4-[5-(3-carboxy-4-hydroxy-1-naphthyl)-5-keto-pentanoyl]-1-hydroxy-2-naphthoic acid Formula: C27H20O8 MolecularWeight: 472.4429

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=C2O)C(=O)O)C(=O)CCCC(=O)C3=CC(=C(C4=CC=CC=C43)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=C2O)C(=O)O)C(=O)CCCC(=O)C3=CC(=C(C4=CC=CC=C43)O)C(=O)O

InChI

InChI=1S/C27H20O8/c28-22(18-12-20(26(32)33)24(30)16-8-3-1-6-14(16)18)10-5-11-23(29)19-13-21(27(34)35)25(31)17-9-4-2-7-15(17)19/h1-4,6-9,12-13,30-31H,5,10-11H2,(H,32,33)(H,34,35)