1-[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxamide chloride

Systemtic Name: 1-[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxamide chloride Openeye Name: 1-[2-(4-bromo-3-methyl-anilino)-2-oxo-ethyl]pyridin-1-ium-3-carboxamide chloride CAS Name: 1-[2-(4-bromo-3-methylanilino)-2-oxoethyl]-3-pyridin-1-iumcarboxamide chloride IUPAC Name: 1-[2-(4-bromo-3-methylanilino)-2-oxoethyl]pyridin-1-ium-3-carboxamide chloride Traditional Name: 1-[2-(4-bromo-3-methyl-anilino)-2-keto-ethyl]pyridin-1-ium-3-carboxamide chloride Formula: C15H15BrClN3O2 MolecularWeight: 384.6555

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C[N+]2=CC=CC(=C2)C(=O)N)Br.[Cl-]

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C[N+]2=CC=CC(=C2)C(=O)N)Br.[Cl-]

InChI

InChI=1S/C15H14BrN3O2.ClH/c1-10-7-12(4-5-13(10)16)18-14(20)9-19-6-2-3-11(8-19)15(17)21;/h2-8H,9H2,1H3,(H2-,17,18,20,21);1H