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

Systemtic Name: N-butan-2-yl-4-chloranyl-N-[1-(4-cyanophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[1-(4-cyanophenyl)-2,5-dioxo-pyrrolidin-3-yl]-3-nitro-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-4-chloro-N-[1-(4-cyanophenyl)-2,5-dioxo-3-pyrrolidinyl]-3-nitrobenzamide IUPAC Name: N-butan-2-yl-4-chloro-N-[1-(4-cyanophenyl)-2,5-dioxopyrrolidin-3-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[1-(4-cyanophenyl)-2,5-diketo-pyrrolidin-3-yl]-3-nitro-N-sec-butyl-benzamide Formula: C22H19ClN4O5 MolecularWeight: 454.86306

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C22H19ClN4O5/c1-3-13(2)25(21(29)15-6-9-17(23)18(10-15)27(31)32)19-11-20(28)26(22(19)30)16-7-4-14(12-24)5-8-16/h4-10,13,19H,3,11H2,1-2H3