O1-cyclohexyl O4-[(4-nitrophenyl)methyl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate

Systemtic Name: O1-cyclohexyl O4-[(4-nitrophenyl)methyl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate Openeye Name: O1-cyclohexyl O4-[(4-nitrophenyl)methyl] (2S)-2-(tert-butoxycarbonylamino)butanedioate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanedioic acid O1-cyclohexyl ester O4-[(4-nitrophenyl)methyl] ester IUPAC Name: 1-O-cyclohexyl 4-O-[(4-nitrophenyl)methyl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)succinic acid O1-cyclohexyl ester O4-(4-nitrobenzyl) ester Formula: C22H30N2O8 MolecularWeight: 450.4822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC2CCCCC2

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC2CCCCC2

InChI

InChI=1S/C22H30N2O8/c1-22(2,3)32-21(27)23-18(20(26)31-17-7-5-4-6-8-17)13-19(25)30-14-15-9-11-16(12-10-15)24(28)29/h9-12,17-18H,4-8,13-14H2,1-3H3,(H,23,27)/t18-/m0/s1