N-butan-2-yl-4-chloranyl-N-[1-(4-iodophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-3-nitro-benzamide

Systemtic Name: N-butan-2-yl-4-chloranyl-N-[1-(4-iodophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[1-(4-iodophenyl)-2,5-dioxo-pyrrolidin-3-yl]-3-nitro-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-4-chloro-N-[1-(4-iodophenyl)-2,5-dioxo-3-pyrrolidinyl]-3-nitrobenzamide IUPAC Name: N-butan-2-yl-4-chloro-N-[1-(4-iodophenyl)-2,5-dioxopyrrolidin-3-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[1-(4-iodophenyl)-2,5-diketo-pyrrolidin-3-yl]-3-nitro-N-sec-butyl-benzamide Formula: C21H19ClIN3O5 MolecularWeight: 555.75013

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClIN3O5/c1-3-12(2)24(20(28)13-4-9-16(22)17(10-13)26(30)31)18-11-19(27)25(21(18)29)15-7-5-14(23)6-8-15/h4-10,12,18H,3,11H2,1-2H3