2-[5-(4-bromophenyl)carbonyl-1-methyl-pyrrol-2-yl]ethanoic acid

Systemtic Name: 2-[5-(4-bromophenyl)carbonyl-1-methyl-pyrrol-2-yl]ethanoic acid Openeye Name: 2-[5-(4-bromobenzoyl)-1-methyl-pyrrol-2-yl]acetic acid CAS Name: 2-[5-[(4-bromophenyl)-oxomethyl]-1-methyl-2-pyrrolyl]acetic acid IUPAC Name: 2-[5-(4-bromobenzoyl)-1-methylpyrrol-2-yl]acetic acid Traditional Name: 2-[5-(4-bromobenzoyl)-1-methyl-pyrrol-2-yl]acetic acid Formula: C14H12BrNO3 MolecularWeight: 322.15398

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C(=O)C2=CC=C(C=C2)Br)CC(=O)O

Isomeric SMILES

CN1C(=CC=C1C(=O)C2=CC=C(C=C2)Br)CC(=O)O

InChI

InChI=1S/C14H12BrNO3/c1-16-11(8-13(17)18)6-7-12(16)14(19)9-2-4-10(15)5-3-9/h2-7H,8H2,1H3,(H,17,18)