(E)-3-(2-bromophenyl)-1-isocyanato-prop-2-en-1-one

Systemtic Name: (E)-3-(2-bromophenyl)-1-isocyanato-prop-2-en-1-one Openeye Name: (E)-3-(2-bromophenyl)prop-2-enoyl isocyanate CAS Name: (E)-3-(2-bromophenyl)-1-isocyanato-2-propen-1-one IUPAC Name: (E)-3-(2-bromophenyl)prop-2-enoyl isocyanate Traditional Name: (E)-3-(2-bromophenyl)-1-isocyanato-prop-2-en-1-one Formula: C10H6BrNO2 MolecularWeight: 252.06414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC(=O)N=C=O)Br

Isomeric SMILES

C1=CC=C(C(=C1)/C=C/C(=O)N=C=O)Br

InChI

InChI=1S/C10H6BrNO2/c11-9-4-2-1-3-8(9)5-6-10(14)12-7-13/h1-6H/b6-5+