3-[(4-methyl-3-nitro-phenyl)carbonylamino]propanoate

Systemtic Name: 3-[(4-methyl-3-nitro-phenyl)carbonylamino]propanoate Openeye Name: 3-[(4-methyl-3-nitro-benzoyl)amino]propanoate CAS Name: 3-[[(4-methyl-3-nitrophenyl)-oxomethyl]amino]propanoate IUPAC Name: 3-[(4-methyl-3-nitrobenzoyl)amino]propanoate Traditional Name: 3-[(4-methyl-3-nitro-benzoyl)amino]propionate Formula: C11H11N2O5- MolecularWeight: 251.21544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCC(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCC(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H12N2O5/c1-7-2-3-8(6-9(7)13(17)18)11(16)12-5-4-10(14)15/h2-3,6H,4-5H2,1H3,(H,12,16)(H,14,15)/p-1