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methyl (2R,3R)-2-methoxy-5-nitro-3-[(phenylmethyl)amino]pentanoate

methyl (2R,3R)-2-methoxy-5-nitro-3-[(phenylmethyl)amino]pentanoate

Systemtic Name:methyl (2R,3R)-2-methoxy-5-nitro-3-[(phenylmethyl)amino]pentanoate
Openeye Name:methyl (2R,3R)-3-(benzylamino)-2-methoxy-5-nitro-pentanoate
CAS Name:(2R,3R)-2-methoxy-5-nitro-3-[(phenylmethyl)amino]pentanoic acid methyl ester
IUPAC Name:methyl (2R,3R)-3-(benzylamino)-2-methoxy-5-nitropentanoate
Traditional Name:(2R,3R)-3-(benzylamino)-2-methoxy-5-nitro-valeric acid methyl ester
Formula: C14H20N2O5
MolecularWeight: 296.319
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C14H20N2O5/c1-20-13(14(17)21-2)12(8-9-16(18)19)15-10-11-6-4-3-5-7-11/h3-7,12-13,15H,8-10H2,1-2H3/t12-,13-/m1/s1


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