[4-[[6-[[(2R)-1-oxidanylbutan-2-yl]amino]pyridin-3-yl]amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[[6-[[(2R)-1-oxidanylbutan-2-yl]amino]pyridin-3-yl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[[6-[[(1R)-1-(hydroxymethyl)propyl]amino]-3-pyridyl]amino]-4-oxo-butyl]ammonium CAS Name: [4-[[6-[[(2R)-1-hydroxybutan-2-yl]amino]-3-pyridinyl]amino]-4-oxobutyl]ammonium IUPAC Name: [4-[[6-[[(2R)-1-hydroxybutan-2-yl]amino]pyridin-3-yl]amino]-4-oxobutyl]azanium Traditional Name: [4-keto-4-[[6-[[(1R)-1-methylolpropyl]amino]-3-pyridyl]amino]butyl]ammonium Formula: C13H23N4O2+ MolecularWeight: 267.34732

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=NC=C(C=C1)NC(=O)CCC[NH3+]

Isomeric SMILES

CC[C@H](CO)NC1=NC=C(C=C1)NC(=O)CCC[NH3+]

InChI

InChI=1S/C13H22N4O2/c1-2-10(9-18)16-12-6-5-11(8-15-12)17-13(19)4-3-7-14/h5-6,8,10,18H,2-4,7,9,14H2,1H3,(H,15,16)(H,17,19)/p+1/t10-/m1/s1