3-[(5-chloranyl-2-nitro-phenyl)methyl-methyl-amino]propanoic acid

Systemtic Name: 3-[(5-chloranyl-2-nitro-phenyl)methyl-methyl-amino]propanoic acid Openeye Name: 3-[(5-chloro-2-nitro-phenyl)methyl-methyl-amino]propanoic acid CAS Name: 3-[(5-chloro-2-nitrophenyl)methyl-methylamino]propanoic acid IUPAC Name: 3-[(5-chloro-2-nitrophenyl)methyl-methylamino]propanoic acid Traditional Name: 3-[(5-chloro-2-nitro-benzyl)-methyl-amino]propionic acid Formula: C11H13ClN2O4 MolecularWeight: 272.68492

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)O)CC1=C(C=CC(=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(CCC(=O)O)CC1=C(C=CC(=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C11H13ClN2O4/c1-13(5-4-11(15)16)7-8-6-9(12)2-3-10(8)14(17)18/h2-3,6H,4-5,7H2,1H3,(H,15,16)