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

Systemtic Name: 2-[2-[bis(azanyl)methylidenecarbamoyl]-1,4-dimethyl-indol-6-yl]ethylphosphonic acid Openeye Name: 2-[2-(diaminomethylenecarbamoyl)-1,4-dimethyl-indol-6-yl]ethylphosphonic acid CAS Name: 2-[2-[(diaminomethylideneamino)-oxomethyl]-1,4-dimethyl-6-indolyl]ethylphosphonic acid IUPAC Name: 2-[2-(diaminomethylidenecarbamoyl)-1,4-dimethylindol-6-yl]ethylphosphonic acid Traditional Name: 2-[2-(diaminomethylenecarbamoyl)-1,4-dimethyl-indol-6-yl]ethylphosphonic acid Formula: C14H19N4O4P MolecularWeight: 338.298821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(N(C2=CC(=C1)CCP(=O)(O)O)C)C(=O)N=C(N)N

Isomeric SMILES

CC1=C2C=C(N(C2=CC(=C1)CCP(=O)(O)O)C)C(=O)N=C(N)N

InChI

InChI=1S/C14H19N4O4P/c1-8-5-9(3-4-23(20,21)22)6-11-10(8)7-12(18(11)2)13(19)17-14(15)16/h5-7H,3-4H2,1-2H3,(H2,20,21,22)(H4,15,16,17,19)