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

Systemtic Name: 2-azanyl-4-(4-butoxyphenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Openeye Name: 2-amino-4-(4-butoxyphenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile CAS Name: 2-amino-4-(4-butoxyphenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile IUPAC Name: 2-amino-4-(4-butoxyphenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Traditional Name: 2-amino-4-(4-butoxyphenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Formula: C20H24N3O+ MolecularWeight: 322.42406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=C(C(=[NH+]C3=C2CCCC3)N)C#N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=C(C(=[NH+]C3=C2CCCC3)N)C#N

InChI

InChI=1S/C20H23N3O/c1-2-3-12-24-15-10-8-14(9-11-15)19-16-6-4-5-7-18(16)23-20(22)17(19)13-21/h8-11H,2-7,12H2,1H3,(H2,22,23)/p+1