2-[3-[bis(azanyl)methylideneamino]phenyl]-3-phosphono-propanoic acid

Systemtic Name: 2-[3-[bis(azanyl)methylideneamino]phenyl]-3-phosphono-propanoic acid Openeye Name: 2-(3-guanidinophenyl)-3-phosphono-propanoic acid CAS Name: 2-[3-(diaminomethylideneamino)phenyl]-3-phosphonopropanoic acid IUPAC Name: 2-[3-(diaminomethylideneamino)phenyl]-3-phosphonopropanoic acid Traditional Name: 2-(3-guanidinophenyl)-3-phosphono-propionic acid Formula: C10H14N3O5P MolecularWeight: 287.209021

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N=C(N)N)C(CP(=O)(O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N=C(N)N)C(CP(=O)(O)O)C(=O)O

InChI

InChI=1S/C10H14N3O5P/c11-10(12)13-7-3-1-2-6(4-7)8(9(14)15)5-19(16,17)18/h1-4,8H,5H2,(H,14,15)(H4,11,12,13)(H2,16,17,18)