1-[5-(4-bromanyl-2-iodanyl-phenoxy)-2-nitro-phenyl]carbonyl-3,3,4,4,5,5-hexaethyl-pyrrolidin-2-one

Systemtic Name: 1-[5-(4-bromanyl-2-iodanyl-phenoxy)-2-nitro-phenyl]carbonyl-3,3,4,4,5,5-hexaethyl-pyrrolidin-2-one Openeye Name: 1-[5-(4-bromo-2-iodo-phenoxy)-2-nitro-benzoyl]-3,3,4,4,5,5-hexaethyl-pyrrolidin-2-one CAS Name: 1-[[5-(4-bromo-2-iodophenoxy)-2-nitrophenyl]-oxomethyl]-3,3,4,4,5,5-hexaethyl-2-pyrrolidinone IUPAC Name: 1-[5-(4-bromo-2-iodophenoxy)-2-nitrobenzoyl]-3,3,4,4,5,5-hexaethylpyrrolidin-2-one Traditional Name: 1-[5-(4-bromo-2-iodo-phenoxy)-2-nitro-benzoyl]-3,3,4,4,5,5-hexaethyl-2-pyrrolidone Formula: C29H36BrIN2O5 MolecularWeight: 699.41501

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)N(C(C1(CC)CC)(CC)CC)C(=O)C2=C(C=CC(=C2)OC3=C(C=C(C=C3)Br)I)[N+](=O)[O-])CC

Isomeric SMILES

CCC1(C(=O)N(C(C1(CC)CC)(CC)CC)C(=O)C2=C(C=CC(=C2)OC3=C(C=C(C=C3)Br)I)[N+](=O)[O-])CC

InChI

InChI=1S/C29H36BrIN2O5/c1-7-27(8-2)26(35)32(29(11-5,12-6)28(27,9-3)10-4)25(34)21-18-20(14-15-23(21)33(36)37)38-24-16-13-19(30)17-22(24)31/h13-18H,7-12H2,1-6H3