(4-nitrophenyl)methyl 4-[[2-(2-methylpropoxy)-2-oxidanylidene-ethyl]amino]but-2-ynoate

Systemtic Name: (4-nitrophenyl)methyl 4-[[2-(2-methylpropoxy)-2-oxidanylidene-ethyl]amino]but-2-ynoate Openeye Name: (4-nitrophenyl)methyl 4-[(2-isobutoxy-2-oxo-ethyl)amino]but-2-ynoate CAS Name: 4-[[2-(2-methylpropoxy)-2-oxoethyl]amino]-2-butynoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-[[2-(2-methylpropoxy)-2-oxoethyl]amino]but-2-ynoate Traditional Name: 4-[(2-isobutoxy-2-keto-ethyl)amino]but-2-ynoic acid (4-nitrobenzyl) ester Formula: C17H20N2O6 MolecularWeight: 348.3505

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)CNCC#CC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)COC(=O)CNCC#CC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O6/c1-13(2)11-24-17(21)10-18-9-3-4-16(20)25-12-14-5-7-15(8-6-14)19(22)23/h5-8,13,18H,9-12H2,1-2H3