3-azanyl-2-[4-[[azanyl(nitramido)methylidene]amino]phenyl]propanoic acid

Systemtic Name: 3-azanyl-2-[4-[[azanyl(nitramido)methylidene]amino]phenyl]propanoic acid Openeye Name: 3-amino-2-[4-[[amino(nitramido)methylene]amino]phenyl]propanoic acid CAS Name: 3-amino-2-[4-[[amino(nitramido)methylidene]amino]phenyl]propanoic acid IUPAC Name: 3-amino-2-[4-[[amino(nitramido)methylidene]amino]phenyl]propanoic acid Traditional Name: 3-amino-2-[4-[[amino(nitramido)methylene]amino]phenyl]propionic acid Formula: C10H13N5O4 MolecularWeight: 267.24132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CN)C(=O)O)N=C(N)N[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(CN)C(=O)O)N=C(N)N[N+](=O)[O-]

InChI

InChI=1S/C10H13N5O4/c11-5-8(9(16)17)6-1-3-7(4-2-6)13-10(12)14-15(18)19/h1-4,8H,5,11H2,(H,16,17)(H3,12,13,14)