6-tert-butyl-1-ethyl-1-naphthalen-1-yl-2,3,4,9-tetrahydropyrido[3,4-b]indole hydrochloride

Systemtic Name: 6-tert-butyl-1-ethyl-1-naphthalen-1-yl-2,3,4,9-tetrahydropyrido[3,4-b]indole hydrochloride Openeye Name: 6-tert-butyl-1-ethyl-1-(1-naphthyl)-2,3,4,9-tetrahydropyrido[3,4-b]indole hydrochloride CAS Name: 6-tert-butyl-1-ethyl-1-(1-naphthalenyl)-2,3,4,9-tetrahydropyrido[3,4-b]indole hydrochloride IUPAC Name: 6-tert-butyl-1-ethyl-1-naphthalen-1-yl-2,3,4,9-tetrahydropyrido[3,4-b]indole hydrochloride Traditional Name: 6-tert-butyl-1-ethyl-1-(1-naphthyl)-2,3,4,9-tetrahydro-$b-carboline hydrochloride Formula: C27H31ClN2 MolecularWeight: 419.00144

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=C(CCN1)C3=C(N2)C=CC(=C3)C(C)(C)C)C4=CC=CC5=CC=CC=C54.Cl

Isomeric SMILES

CCC1(C2=C(CCN1)C3=C(N2)C=CC(=C3)C(C)(C)C)C4=CC=CC5=CC=CC=C54.Cl

InChI

InChI=1S/C27H30N2.ClH/c1-5-27(23-12-8-10-18-9-6-7-11-20(18)23)25-21(15-16-28-27)22-17-19(26(2,3)4)13-14-24(22)29-25;/h6-14,17,28-29H,5,15-16H2,1-4H3;1H