(2-butoxy-2-oxidanylidene-ethyl) 3-[(4-nitrophenyl)carbonylamino]propanoate

Systemtic Name: (2-butoxy-2-oxidanylidene-ethyl) 3-[(4-nitrophenyl)carbonylamino]propanoate Openeye Name: (2-butoxy-2-oxo-ethyl) 3-[(4-nitrobenzoyl)amino]propanoate CAS Name: 3-[[(4-nitrophenyl)-oxomethyl]amino]propanoic acid (2-butoxy-2-oxoethyl) ester IUPAC Name: (2-butoxy-2-oxoethyl) 3-[(4-nitrobenzoyl)amino]propanoate Traditional Name: 3-[(4-nitrobenzoyl)amino]propionic acid (2-butoxy-2-keto-ethyl) ester Formula: C16H20N2O7 MolecularWeight: 352.3392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)COC(=O)CCNC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)COC(=O)CCNC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C16H20N2O7/c1-2-3-10-24-15(20)11-25-14(19)8-9-17-16(21)12-4-6-13(7-5-12)18(22)23/h4-7H,2-3,8-11H2,1H3,(H,17,21)