(1R,6S)-6-[2-(4-fluorophenyl)ethylcarbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6S)-6-[2-(4-fluorophenyl)ethylcarbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6S)-6-[2-(4-fluorophenyl)ethylcarbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-6-[[2-(4-fluorophenyl)ethylamino]-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6S)-6-[2-(4-fluorophenyl)ethylcarbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-6-[2-(4-fluorophenyl)ethylcarbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Formula: C18H21FNO3- MolecularWeight: 318.362643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C(=O)NCCC2=CC=C(C=C2)F)C(=O)[O-])C

Isomeric SMILES

CC1=C(C[C@H]([C@H](C1)C(=O)NCCC2=CC=C(C=C2)F)C(=O)[O-])C

InChI

InChI=1S/C18H22FNO3/c1-11-9-15(16(18(22)23)10-12(11)2)17(21)20-8-7-13-3-5-14(19)6-4-13/h3-6,15-16H,7-10H2,1-2H3,(H,20,21)(H,22,23)/p-1/t15-,16+/m0/s1