ethyl 3-[5-[(E)-dec-1-enyl]-2-nitro-phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: ethyl 3-[5-[(E)-dec-1-enyl]-2-nitro-phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: ethyl 2-(tert-butoxycarbonylamino)-3-[5-[(E)-dec-1-enyl]-2-nitro-phenyl]propanoate CAS Name: 3-[5-[(E)-dec-1-enyl]-2-nitrophenyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[5-[(E)-dec-1-enyl]-2-nitrophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-[5-[(E)-dec-1-enyl]-2-nitro-phenyl]propionic acid ethyl ester Formula: C26H40N2O6 MolecularWeight: 476.6056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CC1=CC(=C(C=C1)[N+](=O)[O-])CC(C(=O)OCC)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCC/C=C/C1=CC(=C(C=C1)[N+](=O)[O-])CC(C(=O)OCC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C26H40N2O6/c1-6-8-9-10-11-12-13-14-15-20-16-17-23(28(31)32)21(18-20)19-22(24(29)33-7-2)27-25(30)34-26(3,4)5/h14-18,22H,6-13,19H2,1-5H3,(H,27,30)/b15-14+