5-cycloheptylcarbonyl-1H-pyrrole-3-carboxylic acid

Systemtic Name: 5-cycloheptylcarbonyl-1H-pyrrole-3-carboxylic acid Openeye Name: 5-(cycloheptanecarbonyl)-1H-pyrrole-3-carboxylic acid CAS Name: 5-[cycloheptyl(oxo)methyl]-1H-pyrrole-3-carboxylic acid IUPAC Name: 5-(cycloheptanecarbonyl)-1H-pyrrole-3-carboxylic acid Traditional Name: 5-(cycloheptanecarbonyl)-1H-pyrrole-3-carboxylic acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C(=O)C2=CC(=CN2)C(=O)O

Isomeric SMILES

C1CCCC(CC1)C(=O)C2=CC(=CN2)C(=O)O

InChI

InChI=1S/C13H17NO3/c15-12(9-5-3-1-2-4-6-9)11-7-10(8-14-11)13(16)17/h7-9,14H,1-6H2,(H,16,17)