1-(4-tert-butylphenyl)-4-(2-chlorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride

Systemtic Name: 1-(4-tert-butylphenyl)-4-(2-chlorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride Openeye Name: 1-(4-tert-butylphenyl)-4-(2-chlorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride CAS Name: 1-(4-tert-butylphenyl)-4-(2-chlorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride IUPAC Name: 1-(4-tert-butylphenyl)-4-(2-chlorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride Traditional Name: 1-(4-tert-butylphenyl)-4-(2-chlorophenyl)-2,3,4,9-tetrahydro-1H-$b-carboline hydrochloride Formula: C27H28Cl2N2 MolecularWeight: 451.43062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2C3=C(C(CN2)C4=CC=CC=C4Cl)C5=CC=CC=C5N3.Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2C3=C(C(CN2)C4=CC=CC=C4Cl)C5=CC=CC=C5N3.Cl

InChI

InChI=1S/C27H27ClN2.ClH/c1-27(2,3)18-14-12-17(13-15-18)25-26-24(20-9-5-7-11-23(20)30-26)21(16-29-25)19-8-4-6-10-22(19)28;/h4-15,21,25,29-30H,16H2,1-3H3;1H