1-[4-[(2S)-butan-2-yl]piperazin-4-ium-1-yl]-3-cyclopentyl-propan-1-one

Systemtic Name: 1-[4-[(2S)-butan-2-yl]piperazin-4-ium-1-yl]-3-cyclopentyl-propan-1-one Openeye Name: 3-cyclopentyl-1-[4-[(1S)-1-methylpropyl]piperazin-4-ium-1-yl]propan-1-one CAS Name: 1-[4-[(2S)-butan-2-yl]-1-piperazin-4-iumyl]-3-cyclopentyl-1-propanone IUPAC Name: 1-[4-[(2S)-butan-2-yl]piperazin-4-ium-1-yl]-3-cyclopentylpropan-1-one Traditional Name: 3-cyclopentyl-1-[4-[(1S)-1-methylpropyl]piperazin-4-ium-1-yl]propan-1-one Formula: C16H31N2O+ MolecularWeight: 267.43014

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH+]1CCN(CC1)C(=O)CCC2CCCC2

Isomeric SMILES

CC[C@H](C)[NH+]1CCN(CC1)C(=O)CCC2CCCC2

InChI

InChI=1S/C16H30N2O/c1-3-14(2)17-10-12-18(13-11-17)16(19)9-8-15-6-4-5-7-15/h14-15H,3-13H2,1-2H3/p+1/t14-/m0/s1