2-[[4-[[4-methoxy-8-(3-phosphonooxypropoxy)naphthalen-1-yl]methyl]phenyl]sulfonylamino]pentanedioic acid

Systemtic Name: 2-[[4-[[4-methoxy-8-(3-phosphonooxypropoxy)naphthalen-1-yl]methyl]phenyl]sulfonylamino]pentanedioic acid Openeye Name: 2-[[4-[[4-methoxy-8-(3-phosphonooxypropoxy)-1-naphthyl]methyl]phenyl]sulfonylamino]pentanedioic acid CAS Name: 2-[[4-[[4-methoxy-8-(3-phosphonooxypropoxy)-1-naphthalenyl]methyl]phenyl]sulfonylamino]pentanedioic acid IUPAC Name: 2-[[4-[[4-methoxy-8-(3-phosphonooxypropoxy)naphthalen-1-yl]methyl]phenyl]sulfonylamino]pentanedioic acid Traditional Name: 2-[[4-[[4-methoxy-8-(3-phosphonooxypropoxy)-1-naphthyl]methyl]phenyl]sulfonylamino]glutaric acid Formula: C26H30NO12PS MolecularWeight: 611.554661

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C=CC=C(C2=C(C=C1)CC3=CC=C(C=C3)S(=O)(=O)NC(CCC(=O)O)C(=O)O)OCCCOP(=O)(O)O

Isomeric SMILES

COC1=C2C=CC=C(C2=C(C=C1)CC3=CC=C(C=C3)S(=O)(=O)NC(CCC(=O)O)C(=O)O)OCCCOP(=O)(O)O

InChI

InChI=1S/C26H30NO12PS/c1-37-22-12-8-18(25-20(22)4-2-5-23(25)38-14-3-15-39-40(32,33)34)16-17-6-9-19(10-7-17)41(35,36)27-21(26(30)31)11-13-24(28)29/h2,4-10,12,21,27H,3,11,13-16H2,1H3,(H,28,29)(H,30,31)(H2,32,33,34)