4-(3-methyl-2-phenyl-pentanoyl)-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-(3-methyl-2-phenyl-pentanoyl)-1H-pyrrole-2-carboxylic acid Openeye Name: 4-(3-methyl-2-phenyl-pentanoyl)-1H-pyrrole-2-carboxylic acid CAS Name: 4-(3-methyl-1-oxo-2-phenylpentyl)-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-(3-methyl-2-phenylpentanoyl)-1H-pyrrole-2-carboxylic acid Traditional Name: 4-(3-methyl-2-phenyl-pentanoyl)-1H-pyrrole-2-carboxylic acid Formula: C17H19NO3 MolecularWeight: 285.33766

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=CC=CC=C1)C(=O)C2=CNC(=C2)C(=O)O

Isomeric SMILES

CCC(C)C(C1=CC=CC=C1)C(=O)C2=CNC(=C2)C(=O)O

InChI

InChI=1S/C17H19NO3/c1-3-11(2)15(12-7-5-4-6-8-12)16(19)13-9-14(17(20)21)18-10-13/h4-11,15,18H,3H2,1-2H3,(H,20,21)