2-(3,4-dimethylphenyl)-3-(piperazin-4-ium-1-ylmethyl)imidazo[1,2-a]pyridine

Systemtic Name: 2-(3,4-dimethylphenyl)-3-(piperazin-4-ium-1-ylmethyl)imidazo[1,2-a]pyridine Openeye Name: 2-(3,4-dimethylphenyl)-3-(piperazin-4-ium-1-ylmethyl)imidazo[1,2-a]pyridine CAS Name: 2-(3,4-dimethylphenyl)-3-(1-piperazin-4-iumylmethyl)imidazo[1,2-a]pyridine IUPAC Name: 2-(3,4-dimethylphenyl)-3-(piperazin-4-ium-1-ylmethyl)imidazo[1,2-a]pyridine Traditional Name: 2-(3,4-dimethylphenyl)-3-(piperazin-4-ium-1-ylmethyl)imidazo[1,2-a]pyridine Formula: C20H25N4+ MolecularWeight: 321.4393

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(N3C=CC=CC3=N2)CN4CC[NH2+]CC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(N3C=CC=CC3=N2)CN4CC[NH2+]CC4)C

InChI

InChI=1S/C20H24N4/c1-15-6-7-17(13-16(15)2)20-18(14-23-11-8-21-9-12-23)24-10-4-3-5-19(24)22-20/h3-7,10,13,21H,8-9,11-12,14H2,1-2H3/p+1