6-bromanyl-1-(5-tert-butyl-2-methoxy-phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole

Systemtic Name: 6-bromanyl-1-(5-tert-butyl-2-methoxy-phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole Openeye Name: 6-bromo-1-(5-tert-butyl-2-methoxy-phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole CAS Name: 6-bromo-1-(5-tert-butyl-2-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole IUPAC Name: 6-bromo-1-(5-tert-butyl-2-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole Traditional Name: 6-bromo-1-(5-tert-butyl-2-methoxy-phenyl)-2,3,4,9-tetrahydro-1H-$b-carboline Formula: C22H25BrN2O MolecularWeight: 413.3507

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)C2C3=C(CCN2)C4=C(N3)C=CC(=C4)Br

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)C2C3=C(CCN2)C4=C(N3)C=CC(=C4)Br

InChI

InChI=1S/C22H25BrN2O/c1-22(2,3)13-5-8-19(26-4)17(11-13)20-21-15(9-10-24-20)16-12-14(23)6-7-18(16)25-21/h5-8,11-12,20,24-25H,9-10H2,1-4H3