3-[2-[(3-nitrophenyl)carbonylamino]ethanoylamino]propanoic acid

Systemtic Name: 3-[2-[(3-nitrophenyl)carbonylamino]ethanoylamino]propanoic acid Openeye Name: 3-[[2-[(3-nitrobenzoyl)amino]acetyl]amino]propanoic acid CAS Name: 3-[[2-[[(3-nitrophenyl)-oxomethyl]amino]-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-[[2-[(3-nitrobenzoyl)amino]acetyl]amino]propanoic acid Traditional Name: 3-[[2-[(3-nitrobenzoyl)amino]acetyl]amino]propionic acid Formula: C12H13N3O6 MolecularWeight: 295.24812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NCC(=O)NCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NCC(=O)NCCC(=O)O

InChI

InChI=1S/C12H13N3O6/c16-10(13-5-4-11(17)18)7-14-12(19)8-2-1-3-9(6-8)15(20)21/h1-3,6H,4-5,7H2,(H,13,16)(H,14,19)(H,17,18)