1-[(2-azanyl-4-nitro-naphthalen-1-yl)amino]ethylphosphonic acid

Systemtic Name: 1-[(2-azanyl-4-nitro-naphthalen-1-yl)amino]ethylphosphonic acid Openeye Name: 1-[(2-amino-4-nitro-1-naphthyl)amino]ethylphosphonic acid CAS Name: 1-[(2-amino-4-nitro-1-naphthalenyl)amino]ethylphosphonic acid IUPAC Name: 1-[(2-amino-4-nitronaphthalen-1-yl)amino]ethylphosphonic acid Traditional Name: 1-[(2-amino-4-nitro-1-naphthyl)amino]ethylphosphonic acid Formula: C12H14N3O5P MolecularWeight: 311.230421

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Descriptors Computed from Structure

Canonical SMILES:

CC(NC1=C(C=C(C2=CC=CC=C21)[N+](=O)[O-])N)P(=O)(O)O

Isomeric SMILES

CC(NC1=C(C=C(C2=CC=CC=C21)[N+](=O)[O-])N)P(=O)(O)O

InChI

InChI=1S/C12H14N3O5P/c1-7(21(18,19)20)14-12-9-5-3-2-4-8(9)11(15(16)17)6-10(12)13/h2-7,14H,13H2,1H3,(H2,18,19,20)