(2S)-2-ethyl-1-(4-prop-2-enylpiperazin-4-ium-1-yl)hexan-1-one

Systemtic Name: (2S)-2-ethyl-1-(4-prop-2-enylpiperazin-4-ium-1-yl)hexan-1-one Openeye Name: (2S)-1-(4-allylpiperazin-4-ium-1-yl)-2-ethyl-hexan-1-one CAS Name: (2S)-2-ethyl-1-(4-prop-2-enyl-1-piperazin-4-iumyl)-1-hexanone IUPAC Name: (2S)-2-ethyl-1-(4-prop-2-enylpiperazin-4-ium-1-yl)hexan-1-one Traditional Name: (2S)-1-(4-allylpiperazin-4-ium-1-yl)-2-ethyl-hexan-1-one Formula: C15H29N2O+ MolecularWeight: 253.40356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N1CC[NH+](CC1)CC=C

Isomeric SMILES

CCCC[C@H](CC)C(=O)N1CC[NH+](CC1)CC=C

InChI

InChI=1S/C15H28N2O/c1-4-7-8-14(6-3)15(18)17-12-10-16(9-5-2)11-13-17/h5,14H,2,4,6-13H2,1,3H3/p+1/t14-/m0/s1