(4-tert-butylphenyl)methyl 2-[(3-nitrophenyl)carbonylamino]ethanoate

Systemtic Name: (4-tert-butylphenyl)methyl 2-[(3-nitrophenyl)carbonylamino]ethanoate Openeye Name: (4-tert-butylphenyl)methyl 2-[(3-nitrobenzoyl)amino]acetate CAS Name: 2-[[(3-nitrophenyl)-oxomethyl]amino]acetic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl 2-[(3-nitrobenzoyl)amino]acetate Traditional Name: 2-[(3-nitrobenzoyl)amino]acetic acid (4-tert-butylbenzyl) ester Formula: C20H22N2O5 MolecularWeight: 370.39908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O5/c1-20(2,3)16-9-7-14(8-10-16)13-27-18(23)12-21-19(24)15-5-4-6-17(11-15)22(25)26/h4-11H,12-13H2,1-3H3,(H,21,24)