5-(2-bromophenyl)-3-(but-2-ynylamino)cyclohex-2-en-1-one

Systemtic Name: 5-(2-bromophenyl)-3-(but-2-ynylamino)cyclohex-2-en-1-one Openeye Name: 5-(2-bromophenyl)-3-(but-2-ynylamino)cyclohex-2-en-1-one CAS Name: 5-(2-bromophenyl)-3-(but-2-ynylamino)-1-cyclohex-2-enone IUPAC Name: 5-(2-bromophenyl)-3-(but-2-ynylamino)cyclohex-2-en-1-one Traditional Name: 5-(2-bromophenyl)-3-(but-2-ynylamino)cyclohex-2-en-1-one Formula: C16H16BrNO MolecularWeight: 318.20834

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCNC1=CC(=O)CC(C1)C2=CC=CC=C2Br

Isomeric SMILES

CC#CCNC1=CC(=O)CC(C1)C2=CC=CC=C2Br

InChI

InChI=1S/C16H16BrNO/c1-2-3-8-18-13-9-12(10-14(19)11-13)15-6-4-5-7-16(15)17/h4-7,11-12,18H,8-10H2,1H3