(4-nitrophenyl)methyl 2-(3-pyridin-3-ylpropoxycarbonylamino)propanoate

Systemtic Name: (4-nitrophenyl)methyl 2-(3-pyridin-3-ylpropoxycarbonylamino)propanoate Openeye Name: (4-nitrophenyl)methyl 2-[3-(3-pyridyl)propoxycarbonylamino]propanoate CAS Name: 2-[[oxo-[3-(3-pyridinyl)propoxy]methyl]amino]propanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(3-pyridin-3-ylpropoxycarbonylamino)propanoate Traditional Name: 2-[3-(3-pyridyl)propoxycarbonylamino]propionic acid (4-nitrobenzyl) ester Formula: C19H21N3O6 MolecularWeight: 387.38654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)OCCCC2=CN=CC=C2

Isomeric SMILES

CC(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)OCCCC2=CN=CC=C2

InChI

InChI=1S/C19H21N3O6/c1-14(18(23)28-13-16-6-8-17(9-7-16)22(25)26)21-19(24)27-11-3-5-15-4-2-10-20-12-15/h2,4,6-10,12,14H,3,5,11,13H2,1H3,(H,21,24)