(4-nitrophenyl) (2S)-2-(phenylmethoxycarbonylamino)hexanoate

Systemtic Name: (4-nitrophenyl) (2S)-2-(phenylmethoxycarbonylamino)hexanoate Openeye Name: (4-nitrophenyl) (2S)-2-(benzyloxycarbonylamino)hexanoate CAS Name: (2S)-2-(phenylmethoxycarbonylamino)hexanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) (2S)-2-(phenylmethoxycarbonylamino)hexanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)hexanoic acid (4-nitrophenyl) ester Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCC[C@@H](C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H22N2O6/c1-2-3-9-18(21-20(24)27-14-15-7-5-4-6-8-15)19(23)28-17-12-10-16(11-13-17)22(25)26/h4-8,10-13,18H,2-3,9,14H2,1H3,(H,21,24)/t18-/m0/s1