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

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

Systemtic Name:2-azanyl-1-(4-nitrophenyl)propane-1,3-diol; 2-oxidanylbenzoic acid
Openeye Name:2-amino-1-(4-nitrophenyl)propane-1,3-diol; 2-hydroxybenzoic acid
CAS Name:2-amino-1-(4-nitrophenyl)propane-1,3-diol; 2-hydroxybenzoic acid
IUPAC Name:2-amino-1-(4-nitrophenyl)propane-1,3-diol; 2-hydroxybenzoic acid
Traditional Name:2-amino-1-(4-nitrophenyl)propane-1,3-diol; salicylic acid
Formula: C16H18N2O7
MolecularWeight: 350.32332
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C9H12N2O4.C7H6O3/c10-8(5-12)9(13)6-1-3-7(4-2-6)11(14)15;8-6-4-2-1-3-5(6)7(9)10/h1-4,8-9,12-13H,5,10H2;1-4,8H,(H,9,10)


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