[4-[[6-[(2S)-2-ethylpiperidin-1-yl]pyridin-1-ium-3-yl]amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[[6-[(2S)-2-ethylpiperidin-1-yl]pyridin-1-ium-3-yl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[[6-[(2S)-2-ethyl-1-piperidyl]pyridin-1-ium-3-yl]amino]-4-oxo-butyl]ammonium CAS Name: [4-[[6-[(2S)-2-ethyl-1-piperidinyl]-3-pyridin-1-iumyl]amino]-4-oxobutyl]ammonium IUPAC Name: [4-[[6-[(2S)-2-ethylpiperidin-1-yl]pyridin-1-ium-3-yl]amino]-4-oxobutyl]azanium Traditional Name: [4-[[6-[(2S)-2-ethylpiperidino]pyridin-1-ium-3-yl]amino]-4-keto-butyl]ammonium Formula: C16H28N4O+2 MolecularWeight: 292.41972

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=[NH+]C=C(C=C2)NC(=O)CCC[NH3+]

Isomeric SMILES

CC[C@H]1CCCCN1C2=[NH+]C=C(C=C2)NC(=O)CCC[NH3+]

InChI

InChI=1S/C16H26N4O/c1-2-14-6-3-4-11-20(14)15-9-8-13(12-18-15)19-16(21)7-5-10-17/h8-9,12,14H,2-7,10-11,17H2,1H3,(H,19,21)/p+2/t14-/m0/s1