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

Systemtic Name: [4-[[6-[(2S)-2-methylpiperidin-1-yl]pyridin-1-ium-3-yl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[[6-[(2S)-2-methyl-1-piperidyl]pyridin-1-ium-3-yl]amino]-4-oxo-butyl]ammonium CAS Name: [4-[[6-[(2S)-2-methyl-1-piperidinyl]-3-pyridin-1-iumyl]amino]-4-oxobutyl]ammonium IUPAC Name: [4-[[6-[(2S)-2-methylpiperidin-1-yl]pyridin-1-ium-3-yl]amino]-4-oxobutyl]azanium Traditional Name: [4-keto-4-[[6-[(2S)-2-methylpiperidino]pyridin-1-ium-3-yl]amino]butyl]ammonium Formula: C15H26N4O+2 MolecularWeight: 278.39314

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=[NH+]C=C(C=C2)NC(=O)CCC[NH3+]

Isomeric SMILES

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

InChI

InChI=1S/C15H24N4O/c1-12-5-2-3-10-19(12)14-8-7-13(11-17-14)18-15(20)6-4-9-16/h7-8,11-12H,2-6,9-10,16H2,1H3,(H,18,20)/p+2/t12-/m0/s1