[(2S)-4-methyl-2-propan-2-yl-piperazin-4-ium-1-yl]-[5-[(6-methylpyridin-3-yl)oxymethyl]-1,2-oxazol-3-yl]methanone

Systemtic Name: [(2S)-4-methyl-2-propan-2-yl-piperazin-4-ium-1-yl]-[5-[(6-methylpyridin-3-yl)oxymethyl]-1,2-oxazol-3-yl]methanone Openeye Name: [(2S)-2-isopropyl-4-methyl-piperazin-4-ium-1-yl]-[5-[(6-methyl-3-pyridyl)oxymethyl]isoxazol-3-yl]methanone CAS Name: [(2S)-4-methyl-2-propan-2-yl-1-piperazin-4-iumyl]-[5-[(6-methyl-3-pyridinyl)oxymethyl]-3-isoxazolyl]methanone IUPAC Name: [(2S)-4-methyl-2-propan-2-ylpiperazin-4-ium-1-yl]-[5-[(6-methylpyridin-3-yl)oxymethyl]-1,2-oxazol-3-yl]methanone Traditional Name: [(2S)-2-isopropyl-4-methyl-piperazin-4-ium-1-yl]-[5-[(6-methyl-3-pyridyl)oxymethyl]isoxazol-3-yl]methanone Formula: C19H27N4O3+ MolecularWeight: 359.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)OCC2=CC(=NO2)C(=O)N3CC[NH+](CC3C(C)C)C

Isomeric SMILES

CC1=NC=C(C=C1)OCC2=CC(=NO2)C(=O)N3CC[NH+](C[C@@H]3C(C)C)C

InChI

InChI=1S/C19H26N4O3/c1-13(2)18-11-22(4)7-8-23(18)19(24)17-9-16(26-21-17)12-25-15-6-5-14(3)20-10-15/h5-6,9-10,13,18H,7-8,11-12H2,1-4H3/p+1/t18-/m1/s1