(1S,6R)-6-[(phenylmethyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1S,6R)-6-[(phenylmethyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: (1S,6R)-6-(benzylcarbamoyl)cyclohex-3-ene-1-carboxylic acid CAS Name: (1S,6R)-6-[oxo-[(phenylmethyl)amino]methyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1S,6R)-6-(benzylcarbamoyl)cyclohex-3-ene-1-carboxylic acid Traditional Name: (1S,6R)-6-(benzylcarbamoyl)cyclohex-3-ene-1-carboxylic acid Formula: C15H17NO3 MolecularWeight: 259.30038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17NO3/c17-14(16-10-11-6-2-1-3-7-11)12-8-4-5-9-13(12)15(18)19/h1-7,12-13H,8-10H2,(H,16,17)(H,18,19)/t12-,13+/m1/s1