[2-[[2-[2-(4-methoxyphenyl)ethylcarbamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 1-oxidanidylpyridin-1-ium-4-carboxylate

Systemtic Name: [2-[[2-[2-(4-methoxyphenyl)ethylcarbamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 1-oxidanidylpyridin-1-ium-4-carboxylate Openeye Name: [2-[2-[2-(4-methoxyphenyl)ethylcarbamoyl]anilino]-2-oxo-ethyl] 1-oxidopyridin-1-ium-4-carboxylate CAS Name: 1-oxido-4-pyridin-1-iumcarboxylic acid [2-[2-[[2-(4-methoxyphenyl)ethylamino]-oxomethyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-[2-(4-methoxyphenyl)ethylcarbamoyl]anilino]-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate Traditional Name: 1-oxidopyridin-1-ium-4-carboxylic acid [2-keto-2-[2-[2-(4-methoxyphenyl)ethylcarbamoyl]anilino]ethyl] ester Formula: C24H23N3O6 MolecularWeight: 449.45592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC=[N+](C=C3)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC=[N+](C=C3)[O-]

InChI

InChI=1S/C24H23N3O6/c1-32-19-8-6-17(7-9-19)10-13-25-23(29)20-4-2-3-5-21(20)26-22(28)16-33-24(30)18-11-14-27(31)15-12-18/h2-9,11-12,14-15H,10,13,16H2,1H3,(H,25,29)(H,26,28)