tert-butyl 2-(4-methoxyphenyl)-5-oxidanidyl-pyrrolo[3,2-c]pyridin-5-ium-1-carboxylate

Systemtic Name: tert-butyl 2-(4-methoxyphenyl)-5-oxidanidyl-pyrrolo[3,2-c]pyridin-5-ium-1-carboxylate Openeye Name: tert-butyl 2-(4-methoxyphenyl)-5-oxido-pyrrolo[3,2-c]pyridin-5-ium-1-carboxylate CAS Name: 2-(4-methoxyphenyl)-5-oxido-1-pyrrolo[3,2-c]pyridin-5-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-methoxyphenyl)-5-oxidopyrrolo[3,2-c]pyridin-5-ium-1-carboxylate Traditional Name: 2-(4-methoxyphenyl)-5-oxido-pyrrolo[3,2-c]pyridin-5-ium-1-carboxylic acid tert-butyl ester Formula: C19H20N2O4 MolecularWeight: 340.3731

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C=C1C3=CC=C(C=C3)OC)C=[N+](C=C2)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C=C1C3=CC=C(C=C3)OC)C=[N+](C=C2)[O-]

InChI

InChI=1S/C19H20N2O4/c1-19(2,3)25-18(22)21-16-9-10-20(23)12-14(16)11-17(21)13-5-7-15(24-4)8-6-13/h5-12H,1-4H3