methyl 3-[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethoxy]-3-nitro-phenyl]-2-phenoxy-propanoate

Systemtic Name: methyl 3-[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethoxy]-3-nitro-phenyl]-2-phenoxy-propanoate Openeye Name: methyl 3-[4-[2-(tert-butoxycarbonylamino)ethoxy]-3-nitro-phenyl]-2-phenoxy-propanoate CAS Name: 3-[4-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethoxy]-3-nitrophenyl]-2-phenoxypropanoic acid methyl ester IUPAC Name: methyl 3-[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethoxy]-3-nitrophenyl]-2-phenoxypropanoate Traditional Name: 3-[4-[2-(tert-butoxycarbonylamino)ethoxy]-3-nitro-phenyl]-2-phenoxy-propionic acid methyl ester Formula: C23H28N2O8 MolecularWeight: 460.47702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCOC1=C(C=C(C=C1)CC(C(=O)OC)OC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NCCOC1=C(C=C(C=C1)CC(C(=O)OC)OC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C23H28N2O8/c1-23(2,3)33-22(27)24-12-13-31-19-11-10-16(14-18(19)25(28)29)15-20(21(26)30-4)32-17-8-6-5-7-9-17/h5-11,14,20H,12-13,15H2,1-4H3,(H,24,27)