ethyl 7-(1-methylpyridin-1-ium-4-yl)-3-(4-nitrophenyl)carbonyl-indolizine-1-carboxylate

Systemtic Name: ethyl 7-(1-methylpyridin-1-ium-4-yl)-3-(4-nitrophenyl)carbonyl-indolizine-1-carboxylate Openeye Name: ethyl 7-(1-methylpyridin-1-ium-4-yl)-3-(4-nitrobenzoyl)indolizine-1-carboxylate CAS Name: 7-(1-methyl-4-pyridin-1-iumyl)-3-[(4-nitrophenyl)-oxomethyl]-1-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-(1-methylpyridin-1-ium-4-yl)-3-(4-nitrobenzoyl)indolizine-1-carboxylate Traditional Name: 7-(1-methylpyridin-1-ium-4-yl)-3-(4-nitrobenzoyl)indolizine-1-carboxylic acid ethyl ester Formula: C24H20N3O5+ MolecularWeight: 430.4327

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=C(C=CN2C(=C1)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=[N+](C=C4)C

Isomeric SMILES

CCOC(=O)C1=C2C=C(C=CN2C(=C1)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=[N+](C=C4)C

InChI

InChI=1S/C24H20N3O5/c1-3-32-24(29)20-15-22(23(28)17-4-6-19(7-5-17)27(30)31)26-13-10-18(14-21(20)26)16-8-11-25(2)12-9-16/h4-15H,3H2,1-2H3/q+1