N-cyclopentyl-N-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide

Systemtic Name: N-cyclopentyl-N-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide Openeye Name: N-cyclopentyl-5-isopropyl-N-[[1-[2-(o-tolyl)ethyl]piperidin-1-ium-4-yl]methyl]isoxazole-3-carboxamide CAS Name: N-cyclopentyl-N-[[1-[2-(2-methylphenyl)ethyl]-4-piperidin-1-iumyl]methyl]-5-propan-2-yl-3-isoxazolecarboxamide IUPAC Name: N-cyclopentyl-N-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide Traditional Name: N-cyclopentyl-5-isopropyl-N-[[1-[2-(o-tolyl)ethyl]piperidin-1-ium-4-yl]methyl]isoxazole-3-carboxamide Formula: C27H40N3O2+ MolecularWeight: 438.6254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC[NH+]2CCC(CC2)CN(C3CCCC3)C(=O)C4=NOC(=C4)C(C)C

Isomeric SMILES

CC1=CC=CC=C1CC[NH+]2CCC(CC2)CN(C3CCCC3)C(=O)C4=NOC(=C4)C(C)C

InChI

InChI=1S/C27H39N3O2/c1-20(2)26-18-25(28-32-26)27(31)30(24-10-6-7-11-24)19-22-12-15-29(16-13-22)17-14-23-9-5-4-8-21(23)3/h4-5,8-9,18,20,22,24H,6-7,10-17,19H2,1-3H3/p+1