4-(4-butylcyclohexyl)carbonyl-1-methyl-pyrrole-2-carboxylic acid

Systemtic Name: 4-(4-butylcyclohexyl)carbonyl-1-methyl-pyrrole-2-carboxylic acid Openeye Name: 4-(4-butylcyclohexanecarbonyl)-1-methyl-pyrrole-2-carboxylic acid CAS Name: 4-[(4-butylcyclohexyl)-oxomethyl]-1-methyl-2-pyrrolecarboxylic acid IUPAC Name: 4-(4-butylcyclohexanecarbonyl)-1-methylpyrrole-2-carboxylic acid Traditional Name: 4-(4-butylcyclohexanecarbonyl)-1-methyl-pyrrole-2-carboxylic acid Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)C2=CN(C(=C2)C(=O)O)C

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)C2=CN(C(=C2)C(=O)O)C

InChI

InChI=1S/C17H25NO3/c1-3-4-5-12-6-8-13(9-7-12)16(19)14-10-15(17(20)21)18(2)11-14/h10-13H,3-9H2,1-2H3,(H,20,21)