O4-cyclohexyl O1-[(4-nitrophenyl)methyl] (2S)-2-(phenylmethoxycarbonylamino)butanedioate

Systemtic Name: O4-cyclohexyl O1-[(4-nitrophenyl)methyl] (2S)-2-(phenylmethoxycarbonylamino)butanedioate Openeye Name: O4-cyclohexyl O1-[(4-nitrophenyl)methyl] (2S)-2-(benzyloxycarbonylamino)butanedioate CAS Name: (2S)-2-(phenylmethoxycarbonylamino)butanedioic acid O4-cyclohexyl ester O1-[(4-nitrophenyl)methyl] ester IUPAC Name: 4-O-cyclohexyl 1-O-[(4-nitrophenyl)methyl] (2S)-2-(phenylmethoxycarbonylamino)butanedioate Traditional Name: (2S)-2-(benzyloxycarbonylamino)succinic acid O4-cyclohexyl ester O1-(4-nitrobenzyl) ester Formula: C25H28N2O8 MolecularWeight: 484.49842

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)CC(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)OC(=O)C[C@@H](C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H28N2O8/c28-23(35-21-9-5-2-6-10-21)15-22(26-25(30)34-17-18-7-3-1-4-8-18)24(29)33-16-19-11-13-20(14-12-19)27(31)32/h1,3-4,7-8,11-14,21-22H,2,5-6,9-10,15-17H2,(H,26,30)/t22-/m0/s1