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

Systemtic Name: 4-[3-(3-carboxy-4-oxidanyl-naphthalen-1-yl)-3-oxidanylidene-propanoyl]-1-oxidanyl-naphthalene-2-carboxylic acid Openeye Name: 4-[3-(3-carboxy-4-hydroxy-1-naphthyl)-3-oxo-propanoyl]-1-hydroxy-naphthalene-2-carboxylic acid CAS Name: 4-[3-(3-carboxy-4-hydroxy-1-naphthalenyl)-1,3-dioxopropyl]-1-hydroxy-2-naphthalenecarboxylic acid IUPAC Name: 4-[3-(3-carboxy-4-hydroxynaphthalen-1-yl)-3-oxopropanoyl]-1-hydroxynaphthalene-2-carboxylic acid Traditional Name: 4-[3-(3-carboxy-4-hydroxy-1-naphthyl)-3-keto-propanoyl]-1-hydroxy-2-naphthoic acid Formula: C25H16O8 MolecularWeight: 444.38974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C25H16O8/c26-20(16-9-18(24(30)31)22(28)14-7-3-1-5-12(14)16)11-21(27)17-10-19(25(32)33)23(29)15-8-4-2-6-13(15)17/h1-10,28-29H,11H2,(H,30,31)(H,32,33)