1-[2-[[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[[2-(5-chloro-2-methoxy-anilino)-2-oxo-ethyl]-methyl-amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-methylamino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-methylamino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-[[2-(5-chloro-2-methoxy-anilino)-2-keto-ethyl]-methyl-amino]-2-keto-ethyl]piperidin-1-ium-4-carboxamide Formula: C18H26ClN4O4+ MolecularWeight: 397.87644

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=C(C=CC(=C1)Cl)OC)C(=O)C[NH+]2CCC(CC2)C(=O)N

Isomeric SMILES

CN(CC(=O)NC1=C(C=CC(=C1)Cl)OC)C(=O)C[NH+]2CCC(CC2)C(=O)N

InChI

InChI=1S/C18H25ClN4O4/c1-22(17(25)11-23-7-5-12(6-8-23)18(20)26)10-16(24)21-14-9-13(19)3-4-15(14)27-2/h3-4,9,12H,5-8,10-11H2,1-2H3,(H2,20,26)(H,21,24)/p+1