2-methoxyethyl 1-[2-[(2,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl]pyridin-1-ium-4-carboxylate bromide

Systemtic Name: 2-methoxyethyl 1-[2-[(2,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl]pyridin-1-ium-4-carboxylate bromide Openeye Name: 2-methoxyethyl 1-[2-(2,4-dichloroanilino)-2-oxo-ethyl]pyridin-1-ium-4-carboxylate bromide CAS Name: 1-[2-(2,4-dichloroanilino)-2-oxoethyl]-4-pyridin-1-iumcarboxylic acid 2-methoxyethyl ester bromide IUPAC Name: 2-methoxyethyl 1-[2-(2,4-dichloroanilino)-2-oxoethyl]pyridin-1-ium-4-carboxylate bromide Traditional Name: 1-[2-(2,4-dichloroanilino)-2-keto-ethyl]pyridin-1-ium-4-carboxylic acid 2-methoxyethyl ester bromide Formula: C17H17BrCl2N2O4 MolecularWeight: 464.13788

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C1=CC=[N+](C=C1)CC(=O)NC2=C(C=C(C=C2)Cl)Cl.[Br-]

Isomeric SMILES

COCCOC(=O)C1=CC=[N+](C=C1)CC(=O)NC2=C(C=C(C=C2)Cl)Cl.[Br-]

InChI

InChI=1S/C17H16Cl2N2O4.BrH/c1-24-8-9-25-17(23)12-4-6-21(7-5-12)11-16(22)20-15-3-2-13(18)10-14(15)19;/h2-7,10H,8-9,11H2,1H3;1H