(1R,6S)-6-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6S)-6-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6S)-6-[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-6-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6S)-6-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]cyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-6-[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]cyclohex-3-ene-1-carboxylate Formula: C16H15N2O3- MolecularWeight: 283.3019

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NOC(=N2)C3CC=CCC3C(=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=NOC(=N2)[C@H]3CC=CC[C@H]3C(=O)[O-]

InChI

InChI=1S/C16H16N2O3/c1-10-5-4-6-11(9-10)14-17-15(21-18-14)12-7-2-3-8-13(12)16(19)20/h2-6,9,12-13H,7-8H2,1H3,(H,19,20)/p-1/t12-,13+/m0/s1