(4-tert-butyl-2-methyl-phenyl) 3-[(4-nitrophenyl)carbonylamino]propanoate

Systemtic Name: (4-tert-butyl-2-methyl-phenyl) 3-[(4-nitrophenyl)carbonylamino]propanoate Openeye Name: (4-tert-butyl-2-methyl-phenyl) 3-[(4-nitrobenzoyl)amino]propanoate CAS Name: 3-[[(4-nitrophenyl)-oxomethyl]amino]propanoic acid (4-tert-butyl-2-methylphenyl) ester IUPAC Name: (4-tert-butyl-2-methylphenyl) 3-[(4-nitrobenzoyl)amino]propanoate Traditional Name: 3-[(4-nitrobenzoyl)amino]propionic acid (4-tert-butyl-2-methyl-phenyl) ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O5/c1-14-13-16(21(2,3)4)7-10-18(14)28-19(24)11-12-22-20(25)15-5-8-17(9-6-15)23(26)27/h5-10,13H,11-12H2,1-4H3,(H,22,25)