(6R)-2-azanyl-4-(4-methoxyphenyl)-6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile

Systemtic Name: (6R)-2-azanyl-4-(4-methoxyphenyl)-6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Openeye Name: (6R)-2-amino-6-(1,1-dimethylpropyl)-4-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile CAS Name: (6R)-2-amino-4-(4-methoxyphenyl)-6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile IUPAC Name: (6R)-2-amino-4-(4-methoxyphenyl)-6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Traditional Name: (6R)-2-amino-6-tert-amyl-4-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Formula: C22H28N3O+ MolecularWeight: 350.47722

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC2=C(C1)C(=C(C(=[NH+]2)N)C#N)C3=CC=C(C=C3)OC

Isomeric SMILES

CCC(C)(C)[C@@H]1CCC2=C(C1)C(=C(C(=[NH+]2)N)C#N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H27N3O/c1-5-22(2,3)15-8-11-19-17(12-15)20(18(13-23)21(24)25-19)14-6-9-16(26-4)10-7-14/h6-7,9-10,15H,5,8,11-12H2,1-4H3,(H2,24,25)/p+1/t15-/m1/s1