N-[(1R,3R)-3-[2-(3-methylphenyl)ethynyl]-3-oxidanyl-cyclohexyl]-1,2-oxazole-5-carboxamide

Systemtic Name: N-[(1R,3R)-3-[2-(3-methylphenyl)ethynyl]-3-oxidanyl-cyclohexyl]-1,2-oxazole-5-carboxamide Openeye Name: N-[(1R,3R)-3-hydroxy-3-[2-(m-tolyl)ethynyl]cyclohexyl]isoxazole-5-carboxamide CAS Name: N-[(1R,3R)-3-hydroxy-3-[2-(3-methylphenyl)ethynyl]cyclohexyl]-5-isoxazolecarboxamide IUPAC Name: N-[(1R,3R)-3-hydroxy-3-[2-(3-methylphenyl)ethynyl]cyclohexyl]-1,2-oxazole-5-carboxamide Traditional Name: N-[(1R,3R)-3-hydroxy-3-[2-(m-tolyl)ethynyl]cyclohexyl]isoxazole-5-carboxamide Formula: C19H20N2O3 MolecularWeight: 324.3737

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C#CC2(CCCC(C2)NC(=O)C3=CC=NO3)O

Isomeric SMILES

CC1=CC=CC(=C1)C#C[C@]2(CCC[C@H](C2)NC(=O)C3=CC=NO3)O

InChI

InChI=1S/C19H20N2O3/c1-14-4-2-5-15(12-14)7-10-19(23)9-3-6-16(13-19)21-18(22)17-8-11-20-24-17/h2,4-5,8,11-12,16,23H,3,6,9,13H2,1H3,(H,21,22)/t16-,19+/m1/s1