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

Systemtic Name: 2-(4-methylphenyl)-3-(piperidin-1-ium-1-ylmethyl)imidazo[2,1-a]isoquinoline Openeye Name: 3-(piperidin-1-ium-1-ylmethyl)-2-(p-tolyl)imidazo[2,1-a]isoquinoline CAS Name: 2-(4-methylphenyl)-3-(1-piperidin-1-iumylmethyl)imidazo[2,1-a]isoquinoline IUPAC Name: 2-(4-methylphenyl)-3-(piperidin-1-ium-1-ylmethyl)imidazo[2,1-a]isoquinoline Traditional Name: 3-(piperidin-1-ium-1-ylmethyl)-2-(p-tolyl)imidaz[2,1-a]isoquinoline Formula: C24H26N3+ MolecularWeight: 356.48334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N3C=CC4=CC=CC=C4C3=N2)C[NH+]5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N3C=CC4=CC=CC=C4C3=N2)C[NH+]5CCCCC5

InChI

InChI=1S/C24H25N3/c1-18-9-11-20(12-10-18)23-22(17-26-14-5-2-6-15-26)27-16-13-19-7-3-4-8-21(19)24(27)25-23/h3-4,7-13,16H,2,5-6,14-15,17H2,1H3/p+1