methyl 2-oxidanylidene-3-(pyridin-1-ium-1-ylamino)indole-7-carboxylate

Systemtic Name: methyl 2-oxidanylidene-3-(pyridin-1-ium-1-ylamino)indole-7-carboxylate Openeye Name: methyl 2-oxo-3-(pyridin-1-ium-1-ylamino)indole-7-carboxylate CAS Name: 2-oxo-3-(1-pyridin-1-iumylamino)-7-indolecarboxylic acid methyl ester IUPAC Name: methyl 2-oxo-3-(pyridin-1-ium-1-ylamino)indole-7-carboxylate Traditional Name: 2-keto-3-(pyridin-1-ium-1-ylamino)indole-7-carboxylic acid methyl ester Formula: C15H12N3O3+ MolecularWeight: 282.27408

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC2=C(C(=O)N=C21)N[N+]3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=CC2=C(C(=O)N=C21)N[N+]3=CC=CC=C3

InChI

InChI=1S/C15H11N3O3/c1-21-15(20)11-7-5-6-10-12(11)16-14(19)13(10)17-18-8-3-2-4-9-18/h2-9H,1H3/p+1