1-ethyl-3-(4-methylpiperidin-1-yl)-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile

Systemtic Name: 1-ethyl-3-(4-methylpiperidin-1-yl)-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile Openeye Name: 1-ethyl-3-(4-methyl-1-piperidyl)-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile CAS Name: 1-ethyl-3-(4-methyl-1-piperidinyl)-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile IUPAC Name: 1-ethyl-3-(4-methylpiperidin-1-yl)-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile Traditional Name: 1-ethyl-3-(4-methylpiperidino)-5,6,7,8-tetrahydroisoquinolin-2-ium-4-carbonitrile Formula: C18H26N3+ MolecularWeight: 284.41914

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2CCCCC2=C(C(=[NH+]1)N3CCC(CC3)C)C#N

Isomeric SMILES

CCC1=C2CCCCC2=C(C(=[NH+]1)N3CCC(CC3)C)C#N

InChI

InChI=1S/C18H25N3/c1-3-17-15-7-5-4-6-14(15)16(12-19)18(20-17)21-10-8-13(2)9-11-21/h13H,3-11H2,1-2H3/p+1