(1S,6S)-6-[(4-fluorophenyl)methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1S,6S)-6-[(4-fluorophenyl)methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: (1S,6S)-6-[(4-fluorophenyl)methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: (1S,6S)-6-[[(4-fluorophenyl)methylamino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1S,6S)-6-[(4-fluorophenyl)methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: (1S,6S)-6-[(4-fluorobenzyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C15H16FNO3 MolecularWeight: 277.290843

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)NCC2=CC=C(C=C2)F)C(=O)O

Isomeric SMILES

C1C=CC[C@@H]([C@H]1C(=O)NCC2=CC=C(C=C2)F)C(=O)O

InChI

InChI=1S/C15H16FNO3/c16-11-7-5-10(6-8-11)9-17-14(18)12-3-1-2-4-13(12)15(19)20/h1-2,5-8,12-13H,3-4,9H2,(H,17,18)(H,19,20)/t12-,13-/m0/s1