(2,6-dimethylphenyl) 3-[(4-nitrophenyl)carbonylamino]propanoate

Systemtic Name: (2,6-dimethylphenyl) 3-[(4-nitrophenyl)carbonylamino]propanoate Openeye Name: (2,6-dimethylphenyl) 3-[(4-nitrobenzoyl)amino]propanoate CAS Name: 3-[[(4-nitrophenyl)-oxomethyl]amino]propanoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 3-[(4-nitrobenzoyl)amino]propanoate Traditional Name: 3-[(4-nitrobenzoyl)amino]propionic acid (2,6-dimethylphenyl) ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O5/c1-12-4-3-5-13(2)17(12)25-16(21)10-11-19-18(22)14-6-8-15(9-7-14)20(23)24/h3-9H,10-11H2,1-2H3,(H,19,22)