N1-(2-bromanyl-4-nitro-phenyl)-N2,N2-bis(phenylmethyl)cyclohex-4-ene-1,2-dicarboxamide

Systemtic Name: N1-(2-bromanyl-4-nitro-phenyl)-N2,N2-bis(phenylmethyl)cyclohex-4-ene-1,2-dicarboxamide Openeye Name: N2,N2-dibenzyl-N1-(2-bromo-4-nitro-phenyl)cyclohex-4-ene-1,2-dicarboxamide CAS Name: N1-(2-bromo-4-nitrophenyl)-N2,N2-bis(phenylmethyl)cyclohex-4-ene-1,2-dicarboxamide IUPAC Name: 2-N,2-N-dibenzyl-1-N-(2-bromo-4-nitrophenyl)cyclohex-4-ene-1,2-dicarboxamide Traditional Name: N',N'-dibenzyl-N-(2-bromo-4-nitro-phenyl)cyclohex-4-ene-1,2-dicarboxamide Formula: C28H26BrN3O4 MolecularWeight: 548.42774

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br)C(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1C=CCC(C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br)C(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C28H26BrN3O4/c29-25-17-22(32(35)36)15-16-26(25)30-27(33)23-13-7-8-14-24(23)28(34)31(18-20-9-3-1-4-10-20)19-21-11-5-2-6-12-21/h1-12,15-17,23-24H,13-14,18-19H2,(H,30,33)