(4-nitrophenyl)methyl 2-[2-(3-methylphenyl)ethoxycarbonylamino]propanoate

Systemtic Name: (4-nitrophenyl)methyl 2-[2-(3-methylphenyl)ethoxycarbonylamino]propanoate Openeye Name: (4-nitrophenyl)methyl 2-[2-(m-tolyl)ethoxycarbonylamino]propanoate CAS Name: 2-[[2-(3-methylphenyl)ethoxy-oxomethyl]amino]propanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-[2-(3-methylphenyl)ethoxycarbonylamino]propanoate Traditional Name: 2-[2-(m-tolyl)ethoxycarbonylamino]propionic acid (4-nitrobenzyl) ester Formula: C20H22N2O6 MolecularWeight: 386.39848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O6/c1-14-4-3-5-16(12-14)10-11-27-20(24)21-15(2)19(23)28-13-17-6-8-18(9-7-17)22(25)26/h3-9,12,15H,10-11,13H2,1-2H3,(H,21,24)