methyl 5-bromanyl-2-methoxy-4-pyrrol-1-yl-benzoate

Systemtic Name: methyl 5-bromanyl-2-methoxy-4-pyrrol-1-yl-benzoate Openeye Name: methyl 5-bromo-2-methoxy-4-pyrrol-1-yl-benzoate CAS Name: 5-bromo-2-methoxy-4-(1-pyrrolyl)benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-methoxy-4-pyrrol-1-ylbenzoate Traditional Name: 5-bromo-2-methoxy-4-pyrrol-1-yl-benzoic acid methyl ester Formula: C13H12BrNO3 MolecularWeight: 310.14328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OC)Br)N2C=CC=C2

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OC)Br)N2C=CC=C2

InChI

InChI=1S/C13H12BrNO3/c1-17-12-8-11(15-5-3-4-6-15)10(14)7-9(12)13(16)18-2/h3-8H,1-2H3