1-(4-bromanyl-2-hex-1-ynyl-phenyl)pyrrolidin-2-one

Systemtic Name: 1-(4-bromanyl-2-hex-1-ynyl-phenyl)pyrrolidin-2-one Openeye Name: 1-(4-bromo-2-hex-1-ynyl-phenyl)pyrrolidin-2-one CAS Name: 1-(4-bromo-2-hex-1-ynylphenyl)-2-pyrrolidinone IUPAC Name: 1-(4-bromo-2-hex-1-ynylphenyl)pyrrolidin-2-one Traditional Name: 1-(4-bromo-2-hex-1-ynyl-phenyl)-2-pyrrolidone Formula: C16H18BrNO MolecularWeight: 320.22422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=C(C=CC(=C1)Br)N2CCCC2=O

Isomeric SMILES

CCCCC#CC1=C(C=CC(=C1)Br)N2CCCC2=O

InChI

InChI=1S/C16H18BrNO/c1-2-3-4-5-7-13-12-14(17)9-10-15(13)18-11-6-8-16(18)19/h9-10,12H,2-4,6,8,11H2,1H3