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

Systemtic Name: 2-azanyl-1-(4-nitrophenyl)propane-1,3-diol; butanedioic acid Openeye Name: 2-amino-1-(4-nitrophenyl)propane-1,3-diol; succinic acid CAS Name: 2-amino-1-(4-nitrophenyl)propane-1,3-diol; butanedioic acid IUPAC Name: 2-amino-1-(4-nitrophenyl)propane-1,3-diol; butanedioic acid Traditional Name: 2-amino-1-(4-nitrophenyl)propane-1,3-diol; succinic acid Formula: C13H18N2O8 MolecularWeight: 330.29062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12N2O4.C4H6O4/c10-8(5-12)9(13)6-1-3-7(4-2-6)11(14)15;5-3(6)1-2-4(7)8/h1-4,8-9,12-13H,5,10H2;1-2H2,(H,5,6)(H,7,8)