methyl 3-azanyl-3-(5-nitro-2-oxidanyl-phenyl)propanoate

Systemtic Name: methyl 3-azanyl-3-(5-nitro-2-oxidanyl-phenyl)propanoate Openeye Name: methyl 3-amino-3-(2-hydroxy-5-nitro-phenyl)propanoate CAS Name: 3-amino-3-(2-hydroxy-5-nitrophenyl)propanoic acid methyl ester IUPAC Name: methyl 3-amino-3-(2-hydroxy-5-nitrophenyl)propanoate Traditional Name: 3-amino-3-(2-hydroxy-5-nitro-phenyl)propionic acid methyl ester Formula: C10H12N2O5 MolecularWeight: 240.21268

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=C(C=CC(=C1)[N+](=O)[O-])O)N

Isomeric SMILES

COC(=O)CC(C1=C(C=CC(=C1)[N+](=O)[O-])O)N

InChI

InChI=1S/C10H12N2O5/c1-17-10(14)5-8(11)7-4-6(12(15)16)2-3-9(7)13/h2-4,8,13H,5,11H2,1H3