4-[4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-2-methyl-3-oxidanylidene-butan-2-yl]oxy-3-nitro-benzoic acid

Systemtic Name: 4-[4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-2-methyl-3-oxidanylidene-butan-2-yl]oxy-3-nitro-benzoic acid Openeye Name: 4-[3-(2,5-dioxopyrrolidin-1-yl)-1,1-dimethyl-2-oxo-propoxy]-3-nitro-benzoic acid CAS Name: 4-[4-(2,5-dioxo-1-pyrrolidinyl)-2-methyl-3-oxobutan-2-yl]oxy-3-nitrobenzoic acid IUPAC Name: 4-[4-(2,5-dioxopyrrolidin-1-yl)-2-methyl-3-oxobutan-2-yl]oxy-3-nitrobenzoic acid Traditional Name: 4-(2-keto-1,1-dimethyl-3-succinimido-propoxy)-3-nitro-benzoic acid Formula: C16H16N2O8 MolecularWeight: 364.30684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)CN1C(=O)CCC1=O)OC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C(=O)CN1C(=O)CCC1=O)OC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O8/c1-16(2,12(19)8-17-13(20)5-6-14(17)21)26-11-4-3-9(15(22)23)7-10(11)18(24)25/h3-4,7H,5-6,8H2,1-2H3,(H,22,23)