[2,5-bis(oxidanylidene)pyrrolidin-1-yl] (2S)-3-methyl-2-[(4-nitrophenyl)methoxycarbonylamino]butanoate

Systemtic Name: [2,5-bis(oxidanylidene)pyrrolidin-1-yl] (2S)-3-methyl-2-[(4-nitrophenyl)methoxycarbonylamino]butanoate Openeye Name: (2,5-dioxopyrrolidin-1-yl) (2S)-3-methyl-2-[(4-nitrophenyl)methoxycarbonylamino]butanoate CAS Name: (2S)-3-methyl-2-[[(4-nitrophenyl)methoxy-oxomethyl]amino]butanoic acid (2,5-dioxo-1-pyrrolidinyl) ester IUPAC Name: (2,5-dioxopyrrolidin-1-yl) (2S)-3-methyl-2-[(4-nitrophenyl)methoxycarbonylamino]butanoate Traditional Name: (2S)-3-methyl-2-[(4-nitrobenzyl)oxycarbonylamino]butyric acid succinimido ester Formula: C17H19N3O8 MolecularWeight: 393.34806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)ON1C(=O)CCC1=O)NC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)[C@@H](C(=O)ON1C(=O)CCC1=O)NC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O8/c1-10(2)15(16(23)28-19-13(21)7-8-14(19)22)18-17(24)27-9-11-3-5-12(6-4-11)20(25)26/h3-6,10,15H,7-9H2,1-2H3,(H,18,24)/t15-/m0/s1