[4-(3-cyano-1-methyl-indol-5-yl)oxy-2,6-dimethoxy-phenyl] dihydrogen phosphate

Systemtic Name: [4-(3-cyano-1-methyl-indol-5-yl)oxy-2,6-dimethoxy-phenyl] dihydrogen phosphate Openeye Name: [4-(3-cyano-1-methyl-indol-5-yl)oxy-2,6-dimethoxy-phenyl] dihydrogen phosphate CAS Name: [4-[(3-cyano-1-methyl-5-indolyl)oxy]-2,6-dimethoxyphenyl] dihydrogen phosphate IUPAC Name: [4-(3-cyano-1-methylindol-5-yl)oxy-2,6-dimethoxyphenyl] dihydrogen phosphate Traditional Name: [4-(3-cyano-1-methyl-indol-5-yl)oxy-2,6-dimethoxy-phenyl] dihydrogen phosphate Formula: C18H17N2O7P MolecularWeight: 404.310541

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)OC3=CC(=C(C(=C3)OC)OP(=O)(O)O)OC)C#N

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)OC3=CC(=C(C(=C3)OC)OP(=O)(O)O)OC)C#N

InChI

InChI=1S/C18H17N2O7P/c1-20-10-11(9-19)14-6-12(4-5-15(14)20)26-13-7-16(24-2)18(17(8-13)25-3)27-28(21,22)23/h4-8,10H,1-3H3,(H2,21,22,23)