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

Systemtic Name: 2-[4-bromanyl-1-methyl-5-(4-methylphenyl)carbonyl-pyrrol-2-yl]ethanoic acid Openeye Name: 2-[4-bromo-1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetic acid CAS Name: 2-[4-bromo-1-methyl-5-[(4-methylphenyl)-oxomethyl]-2-pyrrolyl]acetic acid IUPAC Name: 2-[4-bromo-1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetic acid Traditional Name: 2-(4-bromo-1-methyl-5-p-toluoyl-pyrrol-2-yl)acetic acid Formula: C15H14BrNO3 MolecularWeight: 336.18056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C(C=C(N2C)CC(=O)O)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(C=C(N2C)CC(=O)O)Br

InChI

InChI=1S/C15H14BrNO3/c1-9-3-5-10(6-4-9)15(20)14-12(16)7-11(17(14)2)8-13(18)19/h3-7H,8H2,1-2H3,(H,18,19)