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2-[nitro-(phenylmethyl)amino]pentanedioic acid

2-[nitro-(phenylmethyl)amino]pentanedioic acid

Systemtic Name:2-[nitro-(phenylmethyl)amino]pentanedioic acid
Openeye Name:2-[benzyl(nitro)amino]pentanedioic acid
CAS Name:2-[nitro-(phenylmethyl)amino]pentanedioic acid
IUPAC Name:2-[benzyl(nitro)amino]pentanedioic acid
Traditional Name:2-[benzyl(nitro)amino]glutaric acid
Formula: C12H14N2O6
MolecularWeight: 282.24936
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C12H14N2O6/c15-11(16)7-6-10(12(17)18)13(14(19)20)8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,15,16)(H,17,18)


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