4-[[3-[3,5-bis(oxidanyl)phenoxy]carbonyl-2-oxidanyl-naphthalen-1-yl]methyl]-3-oxidanyl-naphthalene-2-carboxylic acid

Systemtic Name: 4-[[3-[3,5-bis(oxidanyl)phenoxy]carbonyl-2-oxidanyl-naphthalen-1-yl]methyl]-3-oxidanyl-naphthalene-2-carboxylic acid Openeye Name: 4-[[3-(3,5-dihydroxyphenoxy)carbonyl-2-hydroxy-1-naphthyl]methyl]-3-hydroxy-naphthalene-2-carboxylic acid CAS Name: 4-[[3-[(3,5-dihydroxyphenoxy)-oxomethyl]-2-hydroxy-1-naphthalenyl]methyl]-3-hydroxy-2-naphthalenecarboxylic acid IUPAC Name: 4-[[3-(3,5-dihydroxyphenoxy)carbonyl-2-hydroxynaphthalen-1-yl]methyl]-3-hydroxynaphthalene-2-carboxylic acid Traditional Name: 4-[[3-(3,5-dihydroxyphenoxy)carbonyl-2-hydroxy-1-naphthyl]methyl]-3-hydroxy-2-naphthoic acid Formula: C29H20O8 MolecularWeight: 496.4643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)OC5=CC(=CC(=C5)O)O)O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)OC5=CC(=CC(=C5)O)O)O)O)C(=O)O

InChI

InChI=1S/C29H20O8/c30-17-11-18(31)13-19(12-17)37-29(36)25-10-16-6-2-4-8-21(16)23(27(25)33)14-22-20-7-3-1-5-15(20)9-24(26(22)32)28(34)35/h1-13,30-33H,14H2,(H,34,35)