2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-6-[(2,4-dinitrophenyl)amino]hexanoate

Systemtic Name: 2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-6-[(2,4-dinitrophenyl)amino]hexanoate Openeye Name: 6-(2,4-dinitroanilino)-2-(2,5-dioxopyrrolidin-1-yl)hexanoate CAS Name: 6-(2,4-dinitroanilino)-2-(2,5-dioxo-1-pyrrolidinyl)hexanoate IUPAC Name: 6-(2,4-dinitroanilino)-2-(2,5-dioxopyrrolidin-1-yl)hexanoate Traditional Name: 6-(2,4-dinitroanilino)-2-succinimido-hexanoate Formula: C16H17N4O8- MolecularWeight: 393.32818

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1=O)C(CCCCNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1=O)C(CCCCNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C16H18N4O8/c21-14-6-7-15(22)18(14)12(16(23)24)3-1-2-8-17-11-5-4-10(19(25)26)9-13(11)20(27)28/h4-5,9,12,17H,1-3,6-8H2,(H,23,24)/p-1