methyl 1-[2-[8-methyl-2-(3-nitrophenyl)indolizin-3-yl]-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxylate chloride

Systemtic Name: methyl 1-[2-[8-methyl-2-(3-nitrophenyl)indolizin-3-yl]-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxylate chloride Openeye Name: methyl 1-[2-[8-methyl-2-(3-nitrophenyl)indolizin-3-yl]-2-oxo-ethyl]pyridin-1-ium-3-carboxylate chloride CAS Name: 1-[2-[8-methyl-2-(3-nitrophenyl)-3-indolizinyl]-2-oxoethyl]-3-pyridin-1-iumcarboxylic acid methyl ester chloride IUPAC Name: methyl 1-[2-[8-methyl-2-(3-nitrophenyl)indolizin-3-yl]-2-oxoethyl]pyridin-1-ium-3-carboxylate chloride Traditional Name: 1-[2-keto-2-[8-methyl-2-(3-nitrophenyl)indolizin-3-yl]ethyl]pyridin-1-ium-3-carboxylic acid methyl ester chloride Formula: C24H20ClN3O5 MolecularWeight: 465.8857

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=CC(=C2C(=O)C[N+]3=CC=CC(=C3)C(=O)OC)C4=CC(=CC=C4)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CC1=CC=CN2C1=CC(=C2C(=O)C[N+]3=CC=CC(=C3)C(=O)OC)C4=CC(=CC=C4)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C24H20N3O5.ClH/c1-16-6-4-11-26-21(16)13-20(17-7-3-9-19(12-17)27(30)31)23(26)22(28)15-25-10-5-8-18(14-25)24(29)32-2;/h3-14H,15H2,1-2H3;1H/q+1;/p-1