3-(2,4-dinitrophenoxy)-2-phosphonato-propan-1-amine

Systemtic Name: 3-(2,4-dinitrophenoxy)-2-phosphonato-propan-1-amine Openeye Name: 3-(2,4-dinitrophenoxy)-2-phosphonato-propan-1-amine CAS Name: 3-(2,4-dinitrophenoxy)-2-phosphonato-1-propanamine IUPAC Name: 3-(2,4-dinitrophenoxy)-2-phosphonatopropan-1-amine Traditional Name: [3-(2,4-dinitrophenoxy)-2-phosphonato-propyl]amine Formula: C9H10N3O8P-2 MolecularWeight: 319.164761

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12N3O8P/c10-4-7(21(17,18)19)5-20-9-2-1-6(11(13)14)3-8(9)12(15)16/h1-3,7H,4-5,10H2,(H2,17,18,19)/p-2