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

Systemtic Name: 4-[[3-[3-carboxy-1-[(3-carboxy-2-oxidanyl-naphthalen-1-yl)methyl]naphthalen-2-yl]oxycarbonyl-2-oxidanyl-naphthalen-1-yl]methyl]-3-oxidanyl-naphthalene-2-carboxylic acid Openeye Name: 4-[[3-[[3-carboxy-1-[(3-carboxy-2-hydroxy-1-naphthyl)methyl]-2-naphthyl]oxycarbonyl]-2-hydroxy-1-naphthyl]methyl]-3-hydroxy-naphthalene-2-carboxylic acid CAS Name: 4-[[3-[[3-carboxy-1-[(3-carboxy-2-hydroxy-1-naphthalenyl)methyl]-2-naphthalenyl]oxy-oxomethyl]-2-hydroxy-1-naphthalenyl]methyl]-3-hydroxy-2-naphthalenecarboxylic acid IUPAC Name: 4-[[3-[3-carboxy-1-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]naphthalen-2-yl]oxycarbonyl-2-hydroxynaphthalen-1-yl]methyl]-3-hydroxynaphthalene-2-carboxylic acid Traditional Name: 4-[[3-[3-carboxy-1-[(3-carboxy-2-hydroxy-1-naphthyl)methyl]-2-naphthoxy]carbonyl-2-hydroxy-1-naphthyl]methyl]-3-hydroxy-2-naphthoic acid Formula: C46H30O11 MolecularWeight: 758.7238

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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=C(C6=CC=CC=C6C=C5C(=O)O)CC7=C(C(=CC8=CC=CC=C87)C(=O)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=C(C6=CC=CC=C6C=C5C(=O)O)CC7=C(C(=CC8=CC=CC=C87)C(=O)O)O)O)O)C(=O)O

InChI

InChI=1S/C46H30O11/c47-39-31(27-13-5-1-9-23(27)17-35(39)43(50)51)21-32-29-15-7-3-11-25(29)19-37(41(32)49)46(56)57-42-34(30-16-8-4-12-26(30)20-38(42)45(54)55)22-33-28-14-6-2-10-24(28)18-36(40(33)48)44(52)53/h1-20,47-49H,21-22H2,(H,50,51)(H,52,53)(H,54,55)