dimethyl-[2-[[(3R)-3-methyl-5-oxidanylidene-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentanoyl]amino]ethyl]azanium

Systemtic Name: dimethyl-[2-[[(3R)-3-methyl-5-oxidanylidene-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentanoyl]amino]ethyl]azanium Openeye Name: dimethyl-[2-[[(3R)-3-methyl-5-oxo-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentanoyl]amino]ethyl]ammonium CAS Name: dimethyl-[2-[[(3R)-3-methyl-1,5-dioxo-5-[4-(2-pyridin-1-iumyl)-1-piperazinyl]pentyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[[(3R)-3-methyl-5-oxo-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentanoyl]amino]ethyl]azanium Traditional Name: 2-[[(3R)-5-keto-3-methyl-5-(4-pyridin-1-ium-2-ylpiperazino)pentanoyl]amino]ethyl-dimethyl-ammonium Formula: C19H33N5O2+2 MolecularWeight: 363.49762

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NCC[NH+](C)C)CC(=O)N1CCN(CC1)C2=CC=CC=[NH+]2

Isomeric SMILES

C[C@H](CC(=O)NCC[NH+](C)C)CC(=O)N1CCN(CC1)C2=CC=CC=[NH+]2

InChI

InChI=1S/C19H31N5O2/c1-16(14-18(25)21-8-9-22(2)3)15-19(26)24-12-10-23(11-13-24)17-6-4-5-7-20-17/h4-7,16H,8-15H2,1-3H3,(H,21,25)/p+2/t16-/m1/s1