N-tert-butyl-4-chloranyl-N-[1-(4-methoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-3-nitro-benzamide

Systemtic Name: N-tert-butyl-4-chloranyl-N-[1-(4-methoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-3-nitro-benzamide Openeye Name: N-tert-butyl-4-chloro-N-[1-(4-methoxyphenyl)-2,5-dioxo-pyrrolidin-3-yl]-3-nitro-benzamide CAS Name: N-tert-butyl-4-chloro-N-[1-(4-methoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]-3-nitrobenzamide IUPAC Name: N-tert-butyl-4-chloro-N-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-3-nitrobenzamide Traditional Name: N-tert-butyl-4-chloro-N-[2,5-diketo-1-(4-methoxyphenyl)pyrrolidin-3-yl]-3-nitro-benzamide Formula: C22H22ClN3O6 MolecularWeight: 459.87958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(C1CC(=O)N(C1=O)C2=CC=C(C=C2)OC)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)N(C1CC(=O)N(C1=O)C2=CC=C(C=C2)OC)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H22ClN3O6/c1-22(2,3)25(20(28)13-5-10-16(23)17(11-13)26(30)31)18-12-19(27)24(21(18)29)14-6-8-15(32-4)9-7-14/h5-11,18H,12H2,1-4H3