2-[1-(3-bromophenyl)-6-methoxy-3,3,8,8-tetramethyl-4,9-dihydrofuro[2,3-h]isoquinolin-5-yl]ethanenitrile

Systemtic Name: 2-[1-(3-bromophenyl)-6-methoxy-3,3,8,8-tetramethyl-4,9-dihydrofuro[2,3-h]isoquinolin-5-yl]ethanenitrile Openeye Name: 2-[1-(3-bromophenyl)-6-methoxy-3,3,8,8-tetramethyl-4,9-dihydrofuro[2,3-h]isoquinolin-5-yl]acetonitrile CAS Name: 2-[1-(3-bromophenyl)-6-methoxy-3,3,8,8-tetramethyl-4,9-dihydrofuro[2,3-h]isoquinolin-5-yl]acetonitrile IUPAC Name: 2-[1-(3-bromophenyl)-6-methoxy-3,3,8,8-tetramethyl-4,9-dihydrofuro[2,3-h]isoquinolin-5-yl]acetonitrile Traditional Name: 2-[1-(3-bromophenyl)-6-methoxy-3,3,8,8-tetramethyl-4,9-dihydrofur[2,3-h]isoquinolin-5-yl]acetonitrile Formula: C24H25BrN2O2 MolecularWeight: 453.3715

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C3=C(C(=C2CC#N)OC)OC(C3)(C)C)C(=N1)C4=CC(=CC=C4)Br)C

Isomeric SMILES

CC1(CC2=C(C3=C(C(=C2CC#N)OC)OC(C3)(C)C)C(=N1)C4=CC(=CC=C4)Br)C

InChI

InChI=1S/C24H25BrN2O2/c1-23(2)12-17-16(9-10-26)21(28-5)22-18(13-24(3,4)29-22)19(17)20(27-23)14-7-6-8-15(25)11-14/h6-8,11H,9,12-13H2,1-5H3