2-azanyl-1-(4-nitrophenyl)propane-1,3-diol; 2-chloroethylphosphonic acid

Systemtic Name: 2-azanyl-1-(4-nitrophenyl)propane-1,3-diol; 2-chloroethylphosphonic acid Openeye Name: 2-amino-1-(4-nitrophenyl)propane-1,3-diol; 2-chloroethylphosphonic acid CAS Name: 2-amino-1-(4-nitrophenyl)propane-1,3-diol; 2-chloroethylphosphonic acid IUPAC Name: 2-amino-1-(4-nitrophenyl)propane-1,3-diol; 2-chloroethylphosphonic acid Traditional Name: 2-amino-1-(4-nitrophenyl)propane-1,3-diol; 2-chloroethylphosphonic acid Formula: C11H18ClN2O7P MolecularWeight: 356.696581

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C(CO)N)O)[N+](=O)[O-].C(CCl)P(=O)(O)O

Isomeric SMILES

C1=CC(=CC=C1C(C(CO)N)O)[N+](=O)[O-].C(CCl)P(=O)(O)O

InChI

InChI=1S/C9H12N2O4.C2H6ClO3P/c10-8(5-12)9(13)6-1-3-7(4-2-6)11(14)15;3-1-2-7(4,5)6/h1-4,8-9,12-13H,5,10H2;1-2H2,(H2,4,5,6)