O1-(4-nitrophenyl) O4-(phenylmethyl) (2S)-2-(phenylmethoxycarbonylamino)butanedioate

Systemtic Name: O1-(4-nitrophenyl) O4-(phenylmethyl) (2S)-2-(phenylmethoxycarbonylamino)butanedioate Openeye Name: O4-benzyl O1-(4-nitrophenyl) (2S)-2-(benzyloxycarbonylamino)butanedioate CAS Name: (2S)-2-(phenylmethoxycarbonylamino)butanedioic acid O1-(4-nitrophenyl) ester O4-(phenylmethyl) ester IUPAC Name: 4-O-benzyl 1-O-(4-nitrophenyl) (2S)-2-(phenylmethoxycarbonylamino)butanedioate Traditional Name: (2S)-2-(benzyloxycarbonylamino)succinic acid O4-benzyl ester O1-(4-nitrophenyl) ester Formula: C25H22N2O8 MolecularWeight: 478.45078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CC(C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C[C@@H](C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H22N2O8/c28-23(33-16-18-7-3-1-4-8-18)15-22(26-25(30)34-17-19-9-5-2-6-10-19)24(29)35-21-13-11-20(12-14-21)27(31)32/h1-14,22H,15-17H2,(H,26,30)/t22-/m0/s1