4-bromanyl-N-(3-ethynylphenyl)-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-bromanyl-N-(3-ethynylphenyl)-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-bromo-N-(3-ethynylphenyl)-1-methyl-pyrrole-2-carboxamide CAS Name: 4-bromo-N-(3-ethynylphenyl)-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-bromo-N-(3-ethynylphenyl)-1-methylpyrrole-2-carboxamide Traditional Name: 4-bromo-N-(3-ethynylphenyl)-1-methyl-pyrrole-2-carboxamide Formula: C14H11BrN2O MolecularWeight: 303.15394

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=CC=CC(=C2)C#C)Br

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=CC=CC(=C2)C#C)Br

InChI

InChI=1S/C14H11BrN2O/c1-3-10-5-4-6-12(7-10)16-14(18)13-8-11(15)9-17(13)2/h1,4-9H,2H3,(H,16,18)