[2-[bis(azanyl)methylidenecarbamoyl]-1,4-dimethyl-indol-6-yl]oxymethylphosphonic acid

Systemtic Name: [2-[bis(azanyl)methylidenecarbamoyl]-1,4-dimethyl-indol-6-yl]oxymethylphosphonic acid Openeye Name: [2-(diaminomethylenecarbamoyl)-1,4-dimethyl-indol-6-yl]oxymethylphosphonic acid CAS Name: [2-[(diaminomethylideneamino)-oxomethyl]-1,4-dimethyl-6-indolyl]oxymethylphosphonic acid IUPAC Name: [2-(diaminomethylidenecarbamoyl)-1,4-dimethylindol-6-yl]oxymethylphosphonic acid Traditional Name: [2-(diaminomethylenecarbamoyl)-1,4-dimethyl-indol-6-yl]oxymethylphosphonic acid Formula: C13H17N4O5P MolecularWeight: 340.271641

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1C=C(N2C)C(=O)N=C(N)N)OCP(=O)(O)O

Isomeric SMILES

CC1=CC(=CC2=C1C=C(N2C)C(=O)N=C(N)N)OCP(=O)(O)O

InChI

InChI=1S/C13H17N4O5P/c1-7-3-8(22-6-23(19,20)21)4-10-9(7)5-11(17(10)2)12(18)16-13(14)15/h3-5H,6H2,1-2H3,(H2,19,20,21)(H4,14,15,16,18)