(5-chloranyl-2-ethoxy-phenyl)-piperazin-4-ium-1-yl-methanone

Systemtic Name: (5-chloranyl-2-ethoxy-phenyl)-piperazin-4-ium-1-yl-methanone Openeye Name: (5-chloro-2-ethoxy-phenyl)-piperazin-4-ium-1-yl-methanone CAS Name: (5-chloro-2-ethoxyphenyl)-(1-piperazin-4-iumyl)methanone IUPAC Name: (5-chloro-2-ethoxyphenyl)-piperazin-4-ium-1-ylmethanone Traditional Name: (5-chloro-2-ethoxy-phenyl)-piperazin-4-ium-1-yl-methanone Formula: C13H18ClN2O2+ MolecularWeight: 269.74722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C(=O)N2CC[NH2+]CC2

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)C(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C13H17ClN2O2/c1-2-18-12-4-3-10(14)9-11(12)13(17)16-7-5-15-6-8-16/h3-4,9,15H,2,5-8H2,1H3/p+1