(6S)-2-azanyl-4-(4-methoxyphenyl)-6-methyl-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile

Systemtic Name: (6S)-2-azanyl-4-(4-methoxyphenyl)-6-methyl-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Openeye Name: (6S)-2-amino-4-(4-methoxyphenyl)-6-methyl-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile CAS Name: (6S)-2-amino-4-(4-methoxyphenyl)-6-methyl-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile IUPAC Name: (6S)-2-amino-4-(4-methoxyphenyl)-6-methyl-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Traditional Name: (6S)-2-amino-4-(4-methoxyphenyl)-6-methyl-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Formula: C18H20N3O+ MolecularWeight: 294.3709

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=C(C(=[NH+]2)N)C#N)C3=CC=C(C=C3)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O/c1-11-3-8-16-14(9-11)17(15(10-19)18(20)21-16)12-4-6-13(22-2)7-5-12/h4-7,11H,3,8-9H2,1-2H3,(H2,20,21)/p+1/t11-/m0/s1