(1-ethoxycarbonylpiperidin-4-yl)-[(2S)-pentan-2-yl]azanium

Systemtic Name: (1-ethoxycarbonylpiperidin-4-yl)-[(2S)-pentan-2-yl]azanium Openeye Name: (1-ethoxycarbonyl-4-piperidyl)-[(1S)-1-methylbutyl]ammonium CAS Name: (1-ethoxycarbonyl-4-piperidinyl)-[(2S)-pentan-2-yl]ammonium IUPAC Name: (1-ethoxycarbonylpiperidin-4-yl)-[(2S)-pentan-2-yl]azanium Traditional Name: (1-carbethoxy-4-piperidyl)-[(1S)-1-methylbutyl]ammonium Formula: C13H27N2O2+ MolecularWeight: 243.36568

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)[NH2+]C1CCN(CC1)C(=O)OCC

Isomeric SMILES

CCC[C@H](C)[NH2+]C1CCN(CC1)C(=O)OCC

InChI

InChI=1S/C13H26N2O2/c1-4-6-11(3)14-12-7-9-15(10-8-12)13(16)17-5-2/h11-12,14H,4-10H2,1-3H3/p+1/t11-/m0/s1