3-[(4-aminocarbonyl-2-nitro-phenyl)methylamino]propanoic acid

Systemtic Name: 3-[(4-aminocarbonyl-2-nitro-phenyl)methylamino]propanoic acid Openeye Name: 3-[(4-carbamoyl-2-nitro-phenyl)methylamino]propanoic acid CAS Name: 3-[(4-carbamoyl-2-nitrophenyl)methylamino]propanoic acid IUPAC Name: 3-[(4-carbamoyl-2-nitrophenyl)methylamino]propanoic acid Traditional Name: 3-[(4-carbamoyl-2-nitro-benzyl)amino]propionic acid Formula: C11H13N3O5 MolecularWeight: 267.23802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])CNCCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])CNCCC(=O)O

InChI

InChI=1S/C11H13N3O5/c12-11(17)7-1-2-8(9(5-7)14(18)19)6-13-4-3-10(15)16/h1-2,5,13H,3-4,6H2,(H2,12,17)(H,15,16)