4-bromanyl-1-methyl-2,5-diphenyl-pyrrole-3-carboxylic acid

Systemtic Name: 4-bromanyl-1-methyl-2,5-diphenyl-pyrrole-3-carboxylic acid Openeye Name: 4-bromo-1-methyl-2,5-diphenyl-pyrrole-3-carboxylic acid CAS Name: 4-bromo-1-methyl-2,5-diphenyl-3-pyrrolecarboxylic acid IUPAC Name: 4-bromo-1-methyl-2,5-diphenylpyrrole-3-carboxylic acid Traditional Name: 4-bromo-1-methyl-2,5-diphenyl-pyrrole-3-carboxylic acid Formula: C18H14BrNO2 MolecularWeight: 356.21326

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=C1C2=CC=CC=C2)Br)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CN1C(=C(C(=C1C2=CC=CC=C2)Br)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C18H14BrNO2/c1-20-16(12-8-4-2-5-9-12)14(18(21)22)15(19)17(20)13-10-6-3-7-11-13/h2-11H,1H3,(H,21,22)