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

Systemtic Name: 2-bromanyl-N-[1-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]benzamide Openeye Name: 2-bromo-N-[1-[2-(2-ethylanilino)-2-oxo-ethyl]piperidin-1-ium-4-yl]benzamide CAS Name: 2-bromo-N-[1-[2-(2-ethylanilino)-2-oxoethyl]-4-piperidin-1-iumyl]benzamide IUPAC Name: 2-bromo-N-[1-[2-(2-ethylanilino)-2-oxoethyl]piperidin-1-ium-4-yl]benzamide Traditional Name: 2-bromo-N-[1-[2-(2-ethylanilino)-2-keto-ethyl]piperidin-1-ium-4-yl]benzamide Formula: C22H27BrN3O2+ MolecularWeight: 445.37268

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C[NH+]2CCC(CC2)NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C[NH+]2CCC(CC2)NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C22H26BrN3O2/c1-2-16-7-3-6-10-20(16)25-21(27)15-26-13-11-17(12-14-26)24-22(28)18-8-4-5-9-19(18)23/h3-10,17H,2,11-15H2,1H3,(H,24,28)(H,25,27)/p+1