[2-[bis(azanyl)methylidenecarbamoyl]-1,4-dimethyl-indol-7-yl]methylphosphonic acid

Systemtic Name: [2-[bis(azanyl)methylidenecarbamoyl]-1,4-dimethyl-indol-7-yl]methylphosphonic acid Openeye Name: [2-(diaminomethylenecarbamoyl)-1,4-dimethyl-indol-7-yl]methylphosphonic acid CAS Name: [2-[(diaminomethylideneamino)-oxomethyl]-1,4-dimethyl-7-indolyl]methylphosphonic acid IUPAC Name: [2-(diaminomethylidenecarbamoyl)-1,4-dimethylindol-7-yl]methylphosphonic acid Traditional Name: [2-(diaminomethylenecarbamoyl)-1,4-dimethyl-indol-7-yl]methylphosphonic acid Formula: C13H17N4O4P MolecularWeight: 324.272241

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(N(C2=C(C=C1)CP(=O)(O)O)C)C(=O)N=C(N)N

Isomeric SMILES

CC1=C2C=C(N(C2=C(C=C1)CP(=O)(O)O)C)C(=O)N=C(N)N

InChI

InChI=1S/C13H17N4O4P/c1-7-3-4-8(6-22(19,20)21)11-9(7)5-10(17(11)2)12(18)16-13(14)15/h3-5H,6H2,1-2H3,(H2,19,20,21)(H4,14,15,16,18)