methyl (2R,3R)-2-azanyl-3-naphthalen-1-yl-4-nitro-butanoate

Systemtic Name: methyl (2R,3R)-2-azanyl-3-naphthalen-1-yl-4-nitro-butanoate Openeye Name: methyl (2R,3R)-2-amino-3-(1-naphthyl)-4-nitro-butanoate CAS Name: (2R,3R)-2-amino-3-(1-naphthalenyl)-4-nitrobutanoic acid methyl ester IUPAC Name: methyl (2R,3R)-2-amino-3-naphthalen-1-yl-4-nitrobutanoate Traditional Name: (2R,3R)-2-amino-3-(1-naphthyl)-4-nitro-butyric acid methyl ester Formula: C15H16N2O4 MolecularWeight: 288.29854

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C[N+](=O)[O-])C1=CC=CC2=CC=CC=C21)N

Isomeric SMILES

COC(=O)[C@@H]([C@@H](C[N+](=O)[O-])C1=CC=CC2=CC=CC=C21)N

InChI

InChI=1S/C15H16N2O4/c1-21-15(18)14(16)13(9-17(19)20)12-8-4-6-10-5-2-3-7-11(10)12/h2-8,13-14H,9,16H2,1H3/t13-,14+/m0/s1