5-[3-(4-bromophenyl)-4,5-dimethyl-furan-2-yl]hexanenitrile

Systemtic Name: 5-[3-(4-bromophenyl)-4,5-dimethyl-furan-2-yl]hexanenitrile Openeye Name: 5-[3-(4-bromophenyl)-4,5-dimethyl-2-furyl]hexanenitrile CAS Name: 5-[3-(4-bromophenyl)-4,5-dimethyl-2-furanyl]hexanenitrile IUPAC Name: 5-[3-(4-bromophenyl)-4,5-dimethylfuran-2-yl]hexanenitrile Traditional Name: 5-[3-(4-bromophenyl)-4,5-dimethyl-2-furyl]hexanenitrile Formula: C18H20BrNO MolecularWeight: 346.2615

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1C2=CC=C(C=C2)Br)C(C)CCCC#N)C

Isomeric SMILES

CC1=C(OC(=C1C2=CC=C(C=C2)Br)C(C)CCCC#N)C

InChI

InChI=1S/C18H20BrNO/c1-12(6-4-5-11-20)18-17(13(2)14(3)21-18)15-7-9-16(19)10-8-15/h7-10,12H,4-6H2,1-3H3