methyl (2S)-2-[(3-nitrophenyl)methylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl (2S)-2-[(3-nitrophenyl)methylamino]-3-oxidanyl-propanoate Openeye Name: methyl (2S)-3-hydroxy-2-[(3-nitrophenyl)methylamino]propanoate CAS Name: (2S)-3-hydroxy-2-[(3-nitrophenyl)methylamino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-hydroxy-2-[(3-nitrophenyl)methylamino]propanoate Traditional Name: (2S)-3-hydroxy-2-[(3-nitrobenzyl)amino]propionic acid methyl ester Formula: C11H14N2O5 MolecularWeight: 254.23926

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NCC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)[C@H](CO)NCC1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H14N2O5/c1-18-11(15)10(7-14)12-6-8-3-2-4-9(5-8)13(16)17/h2-5,10,12,14H,6-7H2,1H3/t10-/m0/s1