N-[1-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]cyclopropanecarboxamide

Systemtic Name: N-[1-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]cyclopropanecarboxamide Openeye Name: N-[1-[2-(5-chloro-2-methoxy-anilino)-2-oxo-ethyl]piperidin-1-ium-4-yl]cyclopropanecarboxamide CAS Name: N-[1-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-4-piperidin-1-iumyl]cyclopropanecarboxamide IUPAC Name: N-[1-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]piperidin-1-ium-4-yl]cyclopropanecarboxamide Traditional Name: N-[1-[2-(5-chloro-2-methoxy-anilino)-2-keto-ethyl]piperidin-1-ium-4-yl]cyclopropanecarboxamide Formula: C18H25ClN3O3+ MolecularWeight: 366.8624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)C[NH+]2CCC(CC2)NC(=O)C3CC3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)C[NH+]2CCC(CC2)NC(=O)C3CC3

InChI

InChI=1S/C18H24ClN3O3/c1-25-16-5-4-13(19)10-15(16)21-17(23)11-22-8-6-14(7-9-22)20-18(24)12-2-3-12/h4-5,10,12,14H,2-3,6-9,11H2,1H3,(H,20,24)(H,21,23)/p+1