[2-(4-tert-butylphenyl)-6-propan-2-yl-3,4-dihydro-2H-quinolin-1-ium-1-ylidene]methanediamine chloride

Systemtic Name: [2-(4-tert-butylphenyl)-6-propan-2-yl-3,4-dihydro-2H-quinolin-1-ium-1-ylidene]methanediamine chloride Openeye Name: [2-(4-tert-butylphenyl)-6-isopropyl-3,4-dihydro-2H-quinolin-1-ium-1-ylidene]methanediamine chloride CAS Name: [2-(4-tert-butylphenyl)-6-propan-2-yl-3,4-dihydro-2H-quinolin-1-ium-1-ylidene]methanediamine chloride IUPAC Name: [2-(4-tert-butylphenyl)-6-propan-2-yl-3,4-dihydro-2H-quinolin-1-ium-1-ylidene]methanediamine chloride Traditional Name: [amino-[2-(4-tert-butylphenyl)-6-isopropyl-3,4-dihydro-2H-quinolin-1-ium-1-ylidene]methyl]amine chloride Formula: C23H32ClN3 MolecularWeight: 385.97328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)[N+](=C(N)N)C(CC2)C3=CC=C(C=C3)C(C)(C)C.[Cl-]

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)[N+](=C(N)N)C(CC2)C3=CC=C(C=C3)C(C)(C)C.[Cl-]

InChI

InChI=1S/C23H31N3.ClH/c1-15(2)17-8-12-21-18(14-17)9-13-20(26(21)22(24)25)16-6-10-19(11-7-16)23(3,4)5;/h6-8,10-12,14-15,20H,9,13H2,1-5H3,(H3,24,25);1H