2-azanyl-4-[4-methoxy-3-[(4-methylphenoxy)methyl]phenyl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-4-[4-methoxy-3-[(4-methylphenoxy)methyl]phenyl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Openeye Name: 2-amino-4-[4-methoxy-3-[(4-methylphenoxy)methyl]phenyl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile CAS Name: 2-amino-4-[4-methoxy-3-[(4-methylphenoxy)methyl]phenyl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile IUPAC Name: 2-amino-4-[4-methoxy-3-[(4-methylphenoxy)methyl]phenyl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Traditional Name: 2-amino-4-[4-methoxy-3-[(4-methylphenoxy)methyl]phenyl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Formula: C25H26N3O2+ MolecularWeight: 400.49284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=C(C=CC(=C2)C3=C(C(=[NH+]C4=C3CCCC4)N)C#N)OC

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=C(C=CC(=C2)C3=C(C(=[NH+]C4=C3CCCC4)N)C#N)OC

InChI

InChI=1S/C25H25N3O2/c1-16-7-10-19(11-8-16)30-15-18-13-17(9-12-23(18)29-2)24-20-5-3-4-6-22(20)28-25(27)21(24)14-26/h7-13H,3-6,15H2,1-2H3,(H2,27,28)/p+1