(4-nitrophenyl)methyl (2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: (4-nitrophenyl)methyl (2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: (4-nitrophenyl)methyl (2S)-2-(benzyloxycarbonylamino)-4-methyl-pentanoate CAS Name: (2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl (2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-4-methyl-valeric acid (4-nitrobenzyl) ester Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@@H](C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O6/c1-15(2)12-19(22-21(25)29-14-16-6-4-3-5-7-16)20(24)28-13-17-8-10-18(11-9-17)23(26)27/h3-11,15,19H,12-14H2,1-2H3,(H,22,25)/t19-/m0/s1