N-[2,5-bis(oxidanylidene)-1-(4-propan-2-ylphenyl)pyrrolidin-3-yl]-4-chloranyl-3-nitro-N-phenethyl-benzamide

Systemtic Name: N-[2,5-bis(oxidanylidene)-1-(4-propan-2-ylphenyl)pyrrolidin-3-yl]-4-chloranyl-3-nitro-N-phenethyl-benzamide Openeye Name: 4-chloro-N-[1-(4-isopropylphenyl)-2,5-dioxo-pyrrolidin-3-yl]-3-nitro-N-phenethyl-benzamide CAS Name: 4-chloro-N-[2,5-dioxo-1-(4-propan-2-ylphenyl)-3-pyrrolidinyl]-3-nitro-N-phenethylbenzamide IUPAC Name: 4-chloro-N-[2,5-dioxo-1-(4-propan-2-ylphenyl)pyrrolidin-3-yl]-3-nitro-N-phenethylbenzamide Traditional Name: 4-chloro-N-(2,5-diketo-1-p-cumenyl-pyrrolidin-3-yl)-3-nitro-N-phenethyl-benzamide Formula: C28H26ClN3O5 MolecularWeight: 519.97614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CCC3=CC=CC=C3)C(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CCC3=CC=CC=C3)C(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C28H26ClN3O5/c1-18(2)20-8-11-22(12-9-20)31-26(33)17-25(28(31)35)30(15-14-19-6-4-3-5-7-19)27(34)21-10-13-23(29)24(16-21)32(36)37/h3-13,16,18,25H,14-15,17H2,1-2H3