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

Systemtic Name: 3-(piperazin-4-ium-1-ylmethyl)-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine Openeye Name: 2-(4-isopropylphenyl)-3-(piperazin-4-ium-1-ylmethyl)imidazo[1,2-a]pyridine CAS Name: 3-(1-piperazin-4-iumylmethyl)-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine IUPAC Name: 3-(piperazin-4-ium-1-ylmethyl)-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine Traditional Name: 2-p-cumenyl-3-(piperazin-4-ium-1-ylmethyl)imidazo[1,2-a]pyridine Formula: C21H27N4+ MolecularWeight: 335.46588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4/c1-16(2)17-6-8-18(9-7-17)21-19(15-24-13-10-22-11-14-24)25-12-4-3-5-20(25)23-21/h3-9,12,16,22H,10-11,13-15H2,1-2H3/p+1