2-[2-[4-[methyl-(3-nitrophenyl)carbonyl-amino]phenoxy]ethanoylamino]propanoic acid

Systemtic Name: 2-[2-[4-[methyl-(3-nitrophenyl)carbonyl-amino]phenoxy]ethanoylamino]propanoic acid Openeye Name: 2-[[2-[4-[methyl-(3-nitrobenzoyl)amino]phenoxy]acetyl]amino]propanoic acid CAS Name: 2-[[2-[4-[methyl-[(3-nitrophenyl)-oxomethyl]amino]phenoxy]-1-oxoethyl]amino]propanoic acid IUPAC Name: 2-[[2-[4-[methyl-(3-nitrobenzoyl)amino]phenoxy]acetyl]amino]propanoic acid Traditional Name: 2-[[2-[4-[methyl-(3-nitrobenzoyl)amino]phenoxy]acetyl]amino]propionic acid Formula: C19H19N3O7 MolecularWeight: 401.37006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)COC1=CC=C(C=C1)N(C)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)O)NC(=O)COC1=CC=C(C=C1)N(C)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O7/c1-12(19(25)26)20-17(23)11-29-16-8-6-14(7-9-16)21(2)18(24)13-4-3-5-15(10-13)22(27)28/h3-10,12H,11H2,1-2H3,(H,20,23)(H,25,26)