3-(3-methoxy-4-nitro-phenyl)carbonyl-2-(trifluoromethyl)indolizine-1-carboxylic acid

Systemtic Name: 3-(3-methoxy-4-nitro-phenyl)carbonyl-2-(trifluoromethyl)indolizine-1-carboxylic acid Openeye Name: 3-(3-methoxy-4-nitro-benzoyl)-2-(trifluoromethyl)indolizine-1-carboxylic acid CAS Name: 3-[(3-methoxy-4-nitrophenyl)-oxomethyl]-2-(trifluoromethyl)-1-indolizinecarboxylic acid IUPAC Name: 3-(3-methoxy-4-nitrobenzoyl)-2-(trifluoromethyl)indolizine-1-carboxylic acid Traditional Name: 3-(3-methoxy-4-nitro-benzoyl)-2-(trifluoromethyl)indolizine-1-carboxylic acid Formula: C18H11F3N2O6 MolecularWeight: 408.28495

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)C2=C(C(=C3N2C=CC=C3)C(=O)O)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)C2=C(C(=C3N2C=CC=C3)C(=O)O)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H11F3N2O6/c1-29-12-8-9(5-6-10(12)23(27)28)16(24)15-14(18(19,20)21)13(17(25)26)11-4-2-3-7-22(11)15/h2-8H,1H3,(H,25,26)