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

Systemtic Name: [2-[bis(azanyl)methylidenecarbamoyl]-4-chloranyl-1-methyl-indol-7-yl]methylphosphonic acid Openeye Name: [4-chloro-2-(diaminomethylenecarbamoyl)-1-methyl-indol-7-yl]methylphosphonic acid CAS Name: [4-chloro-2-[(diaminomethylideneamino)-oxomethyl]-1-methyl-7-indolyl]methylphosphonic acid IUPAC Name: [4-chloro-2-(diaminomethylidenecarbamoyl)-1-methylindol-7-yl]methylphosphonic acid Traditional Name: [4-chloro-2-(diaminomethylenecarbamoyl)-1-methyl-indol-7-yl]methylphosphonic acid Formula: C12H14ClN4O4P MolecularWeight: 344.690721

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C(C=CC(=C21)CP(=O)(O)O)Cl)C(=O)N=C(N)N

Isomeric SMILES

CN1C(=CC2=C(C=CC(=C21)CP(=O)(O)O)Cl)C(=O)N=C(N)N

InChI

InChI=1S/C12H14ClN4O4P/c1-17-9(11(18)16-12(14)15)4-7-8(13)3-2-6(10(7)17)5-22(19,20)21/h2-4H,5H2,1H3,(H2,19,20,21)(H4,14,15,16,18)