4-[3-(4-bromophenyl)-1-oxidanyl-prop-2-ynyl]benzenecarbonitrile

Systemtic Name: 4-[3-(4-bromophenyl)-1-oxidanyl-prop-2-ynyl]benzenecarbonitrile Openeye Name: 4-[3-(4-bromophenyl)-1-hydroxy-prop-2-ynyl]benzonitrile CAS Name: 4-[3-(4-bromophenyl)-1-hydroxyprop-2-ynyl]benzonitrile IUPAC Name: 4-[3-(4-bromophenyl)-1-hydroxyprop-2-ynyl]benzonitrile Traditional Name: 4-[3-(4-bromophenyl)-1-hydroxy-prop-2-ynyl]benzonitrile Formula: C16H10BrNO MolecularWeight: 312.1607

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CC(C2=CC=C(C=C2)C#N)O)Br

Isomeric SMILES

C1=CC(=CC=C1C#CC(C2=CC=C(C=C2)C#N)O)Br

InChI

InChI=1S/C16H10BrNO/c17-15-8-3-12(4-9-15)5-10-16(19)14-6-1-13(11-18)2-7-14/h1-4,6-9,16,19H