(4E)-4-[(3-bromophenyl)-oxidanyl-methylidene]-5-(2-chlorophenyl)-1-hexadecyl-pyrrolidine-2,3-dione

Systemtic Name: (4E)-4-[(3-bromophenyl)-oxidanyl-methylidene]-5-(2-chlorophenyl)-1-hexadecyl-pyrrolidine-2,3-dione Openeye Name: (4E)-4-[(3-bromophenyl)-hydroxy-methylene]-5-(2-chlorophenyl)-1-hexadecyl-pyrrolidine-2,3-dione CAS Name: (4E)-4-[(3-bromophenyl)-hydroxymethylidene]-5-(2-chlorophenyl)-1-hexadecylpyrrolidine-2,3-dione IUPAC Name: (4E)-4-[(3-bromophenyl)-hydroxymethylidene]-5-(2-chlorophenyl)-1-hexadecylpyrrolidine-2,3-dione Traditional Name: (4E)-4-[(3-bromophenyl)-hydroxy-methylene]-1-cetyl-5-(2-chlorophenyl)pyrrolidine-2,3-quinone Formula: C33H43BrClNO3 MolecularWeight: 617.05642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C(C(=C(C2=CC(=CC=C2)Br)O)C(=O)C1=O)C3=CC=CC=C3Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C(/C(=C(/C2=CC(=CC=C2)Br)\O)/C(=O)C1=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C33H43BrClNO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-23-36-30(27-21-15-16-22-28(27)35)29(32(38)33(36)39)31(37)25-19-18-20-26(34)24-25/h15-16,18-22,24,30,37H,2-14,17,23H2,1H3/b31-29+