[(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxidanylidene-indol-1-yl]methyl dihydrogen phosphate

Systemtic Name: [(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxidanylidene-indol-1-yl]methyl dihydrogen phosphate Openeye Name: [(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylene]-2-oxo-indolin-1-yl]methyl dihydrogen phosphate CAS Name: [(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxo-1-indolyl]methyl dihydrogen phosphate IUPAC Name: [(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxoindol-1-yl]methyl dihydrogen phosphate Traditional Name: [(3E)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylene]-2-keto-indolin-1-yl]methyl dihydrogen phosphate Formula: C16H17N2O5P MolecularWeight: 348.290341

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C=C2C3=CC=CC=C3N(C2=O)COP(=O)(O)O)C

Isomeric SMILES

CC1=CC(=C(N1)/C=C/2\C3=CC=CC=C3N(C2=O)COP(=O)(O)O)C

InChI

InChI=1S/C16H17N2O5P/c1-10-7-11(2)17-14(10)8-13-12-5-3-4-6-15(12)18(16(13)19)9-23-24(20,21)22/h3-8,17H,9H2,1-2H3,(H2,20,21,22)/b13-8+