6-[[4-carboxy-3-(3-oxidanyl-6-oxidanylidene-10H-anthracen-9-yl)phenyl]carbonylamino]hexyl methyl phosphate

Systemtic Name: 6-[[4-carboxy-3-(3-oxidanyl-6-oxidanylidene-10H-anthracen-9-yl)phenyl]carbonylamino]hexyl methyl phosphate Openeye Name: 6-[[4-carboxy-3-(3-hydroxy-6-oxo-10H-anthracen-9-yl)benzoyl]amino]hexyl methyl phosphate CAS Name: 6-[[[4-carboxy-3-(3-hydroxy-6-oxo-10H-anthracen-9-yl)phenyl]-oxomethyl]amino]hexyl methyl phosphate IUPAC Name: 6-[[4-carboxy-3-(3-hydroxy-6-oxo-10H-anthracen-9-yl)benzoyl]amino]hexyl methyl phosphate Traditional Name: 6-[[4-carboxy-3-(3-hydroxy-6-keto-10H-anthracen-9-yl)benzoyl]amino]hexyl methyl phosphate Formula: C29H29NO9P- MolecularWeight: 566.515621

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)([O-])OCCCCCCNC(=O)C1=CC(=C(C=C1)C(=O)O)C2=C3C=CC(=O)C=C3CC4=C2C=CC(=C4)O

Isomeric SMILES

COP(=O)([O-])OCCCCCCNC(=O)C1=CC(=C(C=C1)C(=O)O)C2=C3C=CC(=O)C=C3CC4=C2C=CC(=C4)O

InChI

InChI=1S/C29H30NO9P/c1-38-40(36,37)39-13-5-3-2-4-12-30-28(33)18-6-9-25(29(34)35)26(17-18)27-23-10-7-21(31)15-19(23)14-20-16-22(32)8-11-24(20)27/h6-11,15-17,31H,2-5,12-14H2,1H3,(H,30,33)(H,34,35)(H,36,37)/p-1