2-azanylethyl (3'-oxidanyl-3-oxidanylidene-spiro[2-benzofuran-1,9'-xanthene]-5-yl) hydrogen phosphate

Systemtic Name: 2-azanylethyl (3'-oxidanyl-3-oxidanylidene-spiro[2-benzofuran-1,9'-xanthene]-5-yl) hydrogen phosphate Openeye Name: 2-aminoethyl (3'-hydroxy-3-oxo-spiro[isobenzofuran-1,9'-xanthene]-5-yl) hydrogen phosphate CAS Name: 2-aminoethyl (3'-hydroxy-3-oxo-5-spiro[isobenzofuran-1,9'-xanthene]yl) hydrogen phosphate IUPAC Name: 2-aminoethyl (3'-hydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl) hydrogen phosphate Traditional Name: 2-aminoethyl (3'-hydroxy-3-keto-spiro[phthalan-1,9'-xanthene]-5-yl) hydrogen phosphate Formula: C22H18NO8P MolecularWeight: 455.353981

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3(C4=C(C=C(C=C4)OP(=O)(O)OCCN)C(=O)O3)C5=C(O2)C=C(C=C5)O

Isomeric SMILES

C1=CC=C2C(=C1)C3(C4=C(C=C(C=C4)OP(=O)(O)OCCN)C(=O)O3)C5=C(O2)C=C(C=C5)O

InChI

InChI=1S/C22H18NO8P/c23-9-10-28-32(26,27)31-14-6-8-16-15(12-14)21(25)30-22(16)17-3-1-2-4-19(17)29-20-11-13(24)5-7-18(20)22/h1-8,11-12,24H,9-10,23H2,(H,26,27)