(4-nitrophenyl)methyl 2-[(3,5-dimethylphenyl)carbonylamino]ethanoate

Systemtic Name: (4-nitrophenyl)methyl 2-[(3,5-dimethylphenyl)carbonylamino]ethanoate Openeye Name: (4-nitrophenyl)methyl 2-[(3,5-dimethylbenzoyl)amino]acetate CAS Name: 2-[[(3,5-dimethylphenyl)-oxomethyl]amino]acetic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-[(3,5-dimethylbenzoyl)amino]acetate Traditional Name: 2-[(3,5-dimethylbenzoyl)amino]acetic acid (4-nitrobenzyl) ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NCC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NCC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

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