2-methyl-2-oxidanyl-4-(4-pyrrol-1-ylphenyl)butanoic acid

Systemtic Name: 2-methyl-2-oxidanyl-4-(4-pyrrol-1-ylphenyl)butanoic acid Openeye Name: 2-hydroxy-2-methyl-4-(4-pyrrol-1-ylphenyl)butanoic acid CAS Name: 2-hydroxy-2-methyl-4-[4-(1-pyrrolyl)phenyl]butanoic acid IUPAC Name: 2-hydroxy-2-methyl-4-(4-pyrrol-1-ylphenyl)butanoic acid Traditional Name: 2-hydroxy-2-methyl-4-(4-pyrrol-1-ylphenyl)butyric acid Formula: C15H17NO3 MolecularWeight: 259.30038

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)N2C=CC=C2)(C(=O)O)O

Isomeric SMILES

CC(CCC1=CC=C(C=C1)N2C=CC=C2)(C(=O)O)O

InChI

InChI=1S/C15H17NO3/c1-15(19,14(17)18)9-8-12-4-6-13(7-5-12)16-10-2-3-11-16/h2-7,10-11,19H,8-9H2,1H3,(H,17,18)