[2-[(2,4-dichlorophenyl)methylamino]-2-oxidanylidene-ethyl] 1-oxidanidylpyridin-1-ium-2-carboxylate

Systemtic Name: [2-[(2,4-dichlorophenyl)methylamino]-2-oxidanylidene-ethyl] 1-oxidanidylpyridin-1-ium-2-carboxylate Openeye Name: [2-[(2,4-dichlorophenyl)methylamino]-2-oxo-ethyl] 1-oxidopyridin-1-ium-2-carboxylate CAS Name: 1-oxido-2-pyridin-1-iumcarboxylic acid [2-[(2,4-dichlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2,4-dichlorophenyl)methylamino]-2-oxoethyl] 1-oxidopyridin-1-ium-2-carboxylate Traditional Name: 1-oxidopyridin-1-ium-2-carboxylic acid [2-[(2,4-dichlorobenzyl)amino]-2-keto-ethyl] ester Formula: C15H12Cl2N2O4 MolecularWeight: 355.17278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)C(=O)OCC(=O)NCC2=C(C=C(C=C2)Cl)Cl)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)C(=O)OCC(=O)NCC2=C(C=C(C=C2)Cl)Cl)[O-]

InChI

InChI=1S/C15H12Cl2N2O4/c16-11-5-4-10(12(17)7-11)8-18-14(20)9-23-15(21)13-3-1-2-6-19(13)22/h1-7H,8-9H2,(H,18,20)