(4-nitrophenyl)methyl 2-benzamido-4-methyl-pentanoate

Systemtic Name: (4-nitrophenyl)methyl 2-benzamido-4-methyl-pentanoate Openeye Name: (4-nitrophenyl)methyl 2-benzamido-4-methyl-pentanoate CAS Name: 2-benzamido-4-methylpentanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-benzamido-4-methylpentanoate Traditional Name: 2-benzamido-4-methyl-valeric acid (4-nitrobenzyl) ester Formula: C20H22N2O5 MolecularWeight: 370.39908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H22N2O5/c1-14(2)12-18(21-19(23)16-6-4-3-5-7-16)20(24)27-13-15-8-10-17(11-9-15)22(25)26/h3-11,14,18H,12-13H2,1-2H3,(H,21,23)