1-[(3,5-dimethylphenyl)methyl]-2-methyl-8-phenylmethoxy-3-prop-2-ynyl-imidazo[1,2-a]pyridin-4-ium

Systemtic Name: 1-[(3,5-dimethylphenyl)methyl]-2-methyl-8-phenylmethoxy-3-prop-2-ynyl-imidazo[1,2-a]pyridin-4-ium Openeye Name: 8-benzyloxy-1-[(3,5-dimethylphenyl)methyl]-2-methyl-3-prop-2-ynyl-imidazo[1,2-a]pyridin-4-ium CAS Name: 1-[(3,5-dimethylphenyl)methyl]-2-methyl-8-phenylmethoxy-3-prop-2-ynylimidazo[1,2-a]pyridin-4-ium IUPAC Name: 1-[(3,5-dimethylphenyl)methyl]-2-methyl-8-phenylmethoxy-3-prop-2-ynylimidazo[1,2-a]pyridin-4-ium Traditional Name: 8-benzoxy-1-(3,5-dimethylbenzyl)-2-methyl-3-propargyl-imidazo[1,2-a]pyridin-4-ium Formula: C27H27N2O+ MolecularWeight: 395.51608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CN2C(=C([N+]3=CC=CC(=C23)OCC4=CC=CC=C4)CC#C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)CN2C(=C([N+]3=CC=CC(=C23)OCC4=CC=CC=C4)CC#C)C)C

InChI

InChI=1S/C27H27N2O/c1-5-10-25-22(4)29(18-24-16-20(2)15-21(3)17-24)27-26(13-9-14-28(25)27)30-19-23-11-7-6-8-12-23/h1,6-9,11-17H,10,18-19H2,2-4H3/q+1