(E)-1-(4-bromophenyl)-2-(4-bromophenyl)sulfanyl-3-(3-nitro-4-oxidanyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-bromophenyl)-2-(4-bromophenyl)sulfanyl-3-(3-nitro-4-oxidanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(4-bromophenyl)-2-(4-bromophenyl)sulfanyl-3-(4-hydroxy-3-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-1-(4-bromophenyl)-2-[(4-bromophenyl)thio]-3-(4-hydroxy-3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-(4-bromophenyl)-2-(4-bromophenyl)sulfanyl-3-(4-hydroxy-3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-bromophenyl)-2-[(4-bromophenyl)thio]-3-(4-hydroxy-3-nitro-phenyl)prop-2-en-1-one Formula: C21H13Br2NO4S MolecularWeight: 535.20522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C(=CC2=CC(=C(C=C2)O)[N+](=O)[O-])SC3=CC=C(C=C3)Br)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)/C(=C\C2=CC(=C(C=C2)O)[N+](=O)[O-])/SC3=CC=C(C=C3)Br)Br

InChI

InChI=1S/C21H13Br2NO4S/c22-15-4-2-14(3-5-15)21(26)20(29-17-8-6-16(23)7-9-17)12-13-1-10-19(25)18(11-13)24(27)28/h1-12,25H/b20-12+