(2-hexoxyphenyl)-piperazin-4-ium-1-yl-methanone

Systemtic Name: (2-hexoxyphenyl)-piperazin-4-ium-1-yl-methanone Openeye Name: (2-hexoxyphenyl)-piperazin-4-ium-1-yl-methanone CAS Name: (2-hexoxyphenyl)-(1-piperazin-4-iumyl)methanone IUPAC Name: (2-hexoxyphenyl)-piperazin-4-ium-1-ylmethanone Traditional Name: (2-hexoxyphenyl)-piperazin-4-ium-1-yl-methanone Formula: C17H27N2O2+ MolecularWeight: 291.40848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)N2CC[NH2+]CC2

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C17H26N2O2/c1-2-3-4-7-14-21-16-9-6-5-8-15(16)17(20)19-12-10-18-11-13-19/h5-6,8-9,18H,2-4,7,10-14H2,1H3/p+1