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

Systemtic Name: (1R,6S)-6-[(4-fluorophenyl)methylcarbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6S)-6-[(4-fluorophenyl)methylcarbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-6-[[(4-fluorophenyl)methylamino]-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6S)-6-[(4-fluorophenyl)methylcarbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-6-[(4-fluorobenzyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Formula: C17H19FNO3- MolecularWeight: 304.336063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C(=O)NCC2=CC=C(C=C2)F)C(=O)[O-])C

Isomeric SMILES

CC1=C(C[C@H]([C@H](C1)C(=O)NCC2=CC=C(C=C2)F)C(=O)[O-])C

InChI

InChI=1S/C17H20FNO3/c1-10-7-14(15(17(21)22)8-11(10)2)16(20)19-9-12-3-5-13(18)6-4-12/h3-6,14-15H,7-9H2,1-2H3,(H,19,20)(H,21,22)/p-1/t14-,15+/m0/s1