[2-[[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-2-oxidanylidene-ethyl] pyridine-3-carboxylate

Systemtic Name: [2-[[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-2-oxidanylidene-ethyl] pyridine-3-carboxylate Openeye Name: [2-[[2-(5-chloro-2-methoxy-anilino)-2-oxo-ethyl]-methyl-amino]-2-oxo-ethyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-[[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-methylamino]-2-oxoethyl] ester IUPAC Name: [2-[[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-methylamino]-2-oxoethyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-[[2-(5-chloro-2-methoxy-anilino)-2-keto-ethyl]-methyl-amino]-2-keto-ethyl] ester Formula: C18H18ClN3O5 MolecularWeight: 391.80562

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=C(C=CC(=C1)Cl)OC)C(=O)COC(=O)C2=CN=CC=C2

Isomeric SMILES

CN(CC(=O)NC1=C(C=CC(=C1)Cl)OC)C(=O)COC(=O)C2=CN=CC=C2

InChI

InChI=1S/C18H18ClN3O5/c1-22(17(24)11-27-18(25)12-4-3-7-20-9-12)10-16(23)21-14-8-13(19)5-6-15(14)26-2/h3-9H,10-11H2,1-2H3,(H,21,23)