2-chloranyl-N-[1-[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]benzamide

Systemtic Name: 2-chloranyl-N-[1-[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]benzamide Openeye Name: 2-chloro-N-[1-[2-(2-methoxyanilino)-2-oxo-ethyl]piperidin-1-ium-4-yl]benzamide CAS Name: 2-chloro-N-[1-[2-(2-methoxyanilino)-2-oxoethyl]-4-piperidin-1-iumyl]benzamide IUPAC Name: 2-chloro-N-[1-[2-(2-methoxyanilino)-2-oxoethyl]piperidin-1-ium-4-yl]benzamide Traditional Name: 2-chloro-N-[1-[2-keto-2-(o-anisidino)ethyl]piperidin-1-ium-4-yl]benzamide Formula: C21H25ClN3O3+ MolecularWeight: 402.8945

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C[NH+]2CCC(CC2)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C[NH+]2CCC(CC2)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H24ClN3O3/c1-28-19-9-5-4-8-18(19)24-20(26)14-25-12-10-15(11-13-25)23-21(27)16-6-2-3-7-17(16)22/h2-9,15H,10-14H2,1H3,(H,23,27)(H,24,26)/p+1