(3S)-N,N-diethyl-1-[[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N,N-diethyl-1-[[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methyl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N,N-diethyl-1-[[5-methyl-2-(o-tolyl)oxazol-4-yl]methyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-N,N-diethyl-1-[[5-methyl-2-(2-methylphenyl)-4-oxazolyl]methyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N,N-diethyl-1-[[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methyl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N,N-diethyl-1-[[5-methyl-2-(o-tolyl)oxazol-4-yl]methyl]piperidin-1-ium-3-carboxamide Formula: C22H32N3O2+ MolecularWeight: 370.50838

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCC[NH+](C1)CC2=C(OC(=N2)C3=CC=CC=C3C)C

Isomeric SMILES

CCN(CC)C(=O)[C@H]1CCC[NH+](C1)CC2=C(OC(=N2)C3=CC=CC=C3C)C

InChI

InChI=1S/C22H31N3O2/c1-5-25(6-2)22(26)18-11-9-13-24(14-18)15-20-17(4)27-21(23-20)19-12-8-7-10-16(19)3/h7-8,10,12,18H,5-6,9,11,13-15H2,1-4H3/p+1/t18-/m0/s1