methyl 1-[2-(4-methoxyphenyl)-1-(8-methylindolizin-3-yl)-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxylate

Systemtic Name: methyl 1-[2-(4-methoxyphenyl)-1-(8-methylindolizin-3-yl)-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxylate Openeye Name: methyl 1-[2-(4-methoxyphenyl)-1-(8-methylindolizin-3-yl)-2-oxo-ethyl]pyridin-1-ium-3-carboxylate CAS Name: 1-[2-(4-methoxyphenyl)-1-(8-methyl-3-indolizinyl)-2-oxoethyl]-3-pyridin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(4-methoxyphenyl)-1-(8-methylindolizin-3-yl)-2-oxoethyl]pyridin-1-ium-3-carboxylate Traditional Name: 1-[2-keto-2-(4-methoxyphenyl)-1-(8-methylindolizin-3-yl)ethyl]pyridin-1-ium-3-carboxylic acid methyl ester Formula: C25H23N2O4+ MolecularWeight: 415.46112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=CC=C2C(C(=O)C3=CC=C(C=C3)OC)[N+]4=CC=CC(=C4)C(=O)OC

Isomeric SMILES

CC1=CC=CN2C1=CC=C2C(C(=O)C3=CC=C(C=C3)OC)[N+]4=CC=CC(=C4)C(=O)OC

InChI

InChI=1S/C25H23N2O4/c1-17-6-4-15-27-21(17)12-13-22(27)23(24(28)18-8-10-20(30-2)11-9-18)26-14-5-7-19(16-26)25(29)31-3/h4-16,23H,1-3H3/q+1