ethyl (2S)-2-azanyl-3-(5-nitro-2-oxidanyl-phenyl)propanoate

Systemtic Name: ethyl (2S)-2-azanyl-3-(5-nitro-2-oxidanyl-phenyl)propanoate Openeye Name: ethyl (2S)-2-amino-3-(2-hydroxy-5-nitro-phenyl)propanoate CAS Name: (2S)-2-amino-3-(2-hydroxy-5-nitrophenyl)propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-amino-3-(2-hydroxy-5-nitrophenyl)propanoate Traditional Name: (2S)-2-amino-3-(2-hydroxy-5-nitro-phenyl)propionic acid ethyl ester Formula: C11H14N2O5 MolecularWeight: 254.23926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=C(C=CC(=C1)[N+](=O)[O-])O)N

Isomeric SMILES

CCOC(=O)[C@H](CC1=C(C=CC(=C1)[N+](=O)[O-])O)N

InChI

InChI=1S/C11H14N2O5/c1-2-18-11(15)9(12)6-7-5-8(13(16)17)3-4-10(7)14/h3-5,9,14H,2,6,12H2,1H3/t9-/m0/s1