1-[(4-aminophenyl)methyl]-4-hexyl-1-oxidanidyl-piperazin-1-ium-2-one

Systemtic Name: 1-[(4-aminophenyl)methyl]-4-hexyl-1-oxidanidyl-piperazin-1-ium-2-one Openeye Name: 1-[(4-aminophenyl)methyl]-4-hexyl-1-oxido-piperazin-1-ium-2-one CAS Name: 1-[(4-aminophenyl)methyl]-4-hexyl-1-oxido-2-piperazin-1-iumone IUPAC Name: 1-[(4-aminophenyl)methyl]-4-hexyl-1-oxidopiperazin-1-ium-2-one Traditional Name: 1-(4-aminobenzyl)-4-hexyl-1-oxido-piperazin-1-ium-2-one Formula: C17H27N3O2 MolecularWeight: 305.41518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CC[N+](C(=O)C1)(CC2=CC=C(C=C2)N)[O-]

Isomeric SMILES

CCCCCCN1CC[N+](C(=O)C1)(CC2=CC=C(C=C2)N)[O-]

InChI

InChI=1S/C17H27N3O2/c1-2-3-4-5-10-19-11-12-20(22,17(21)13-19)14-15-6-8-16(18)9-7-15/h6-9H,2-5,10-14,18H2,1H3