(1S,6R)-6-(3-phenylpropylcarbamoyl)cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1S,6R)-6-(3-phenylpropylcarbamoyl)cyclohex-3-ene-1-carboxylic acid Openeye Name: (1S,6R)-6-(3-phenylpropylcarbamoyl)cyclohex-3-ene-1-carboxylic acid CAS Name: (1S,6R)-6-[oxo-(3-phenylpropylamino)methyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1S,6R)-6-(3-phenylpropylcarbamoyl)cyclohex-3-ene-1-carboxylic acid Traditional Name: (1S,6R)-6-(3-phenylpropylcarbamoyl)cyclohex-3-ene-1-carboxylic acid Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)NCCCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1C=CC[C@@H]([C@@H]1C(=O)NCCCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H21NO3/c19-16(14-10-4-5-11-15(14)17(20)21)18-12-6-9-13-7-2-1-3-8-13/h1-5,7-8,14-15H,6,9-12H2,(H,18,19)(H,20,21)/t14-,15+/m1/s1