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2-[[2-nitro-5-(phenylcarbonyl)phenyl]methylamino]butanoic acid

2-[[2-nitro-5-(phenylcarbonyl)phenyl]methylamino]butanoic acid

Systemtic Name:2-[[2-nitro-5-(phenylcarbonyl)phenyl]methylamino]butanoic acid
Openeye Name:2-[(5-benzoyl-2-nitro-phenyl)methylamino]butanoic acid
CAS Name:2-[(5-benzoyl-2-nitrophenyl)methylamino]butanoic acid
IUPAC Name:2-[(5-benzoyl-2-nitrophenyl)methylamino]butanoic acid
Traditional Name:2-[(5-benzoyl-2-nitro-benzyl)amino]butyric acid
Formula: C18H18N2O5
MolecularWeight: 342.34592
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NCC1=C(C=CC(=C1)C(=O)C2=CC=CC=C2)[N+](=O)[O-]


Isomeric SMILES

CCC(C(=O)O)NCC1=C(C=CC(=C1)C(=O)C2=CC=CC=C2)[N+](=O)[O-]


InChI

InChI=1S/C18H18N2O5/c1-2-15(18(22)23)19-11-14-10-13(8-9-16(14)20(24)25)17(21)12-6-4-3-5-7-12/h3-10,15,19H,2,11H2,1H3,(H,22,23)


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