2-(4-methoxyphenyl)-3-(piperidin-1-ium-1-ylmethyl)imidazo[2,1-a]isoquinoline

Systemtic Name: 2-(4-methoxyphenyl)-3-(piperidin-1-ium-1-ylmethyl)imidazo[2,1-a]isoquinoline Openeye Name: 2-(4-methoxyphenyl)-3-(piperidin-1-ium-1-ylmethyl)imidazo[2,1-a]isoquinoline CAS Name: 2-(4-methoxyphenyl)-3-(1-piperidin-1-iumylmethyl)imidazo[2,1-a]isoquinoline IUPAC Name: 2-(4-methoxyphenyl)-3-(piperidin-1-ium-1-ylmethyl)imidazo[2,1-a]isoquinoline Traditional Name: 2-(4-methoxyphenyl)-3-(piperidin-1-ium-1-ylmethyl)imidaz[2,1-a]isoquinoline Formula: C24H26N3O+ MolecularWeight: 372.48274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(N3C=CC4=CC=CC=C4C3=N2)C[NH+]5CCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(N3C=CC4=CC=CC=C4C3=N2)C[NH+]5CCCCC5

InChI

InChI=1S/C24H25N3O/c1-28-20-11-9-19(10-12-20)23-22(17-26-14-5-2-6-15-26)27-16-13-18-7-3-4-8-21(18)24(27)25-23/h3-4,7-13,16H,2,5-6,14-15,17H2,1H3/p+1