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

Systemtic Name: 4-bromanyl-N-(3-ethynylphenyl)-1-propyl-pyrrole-2-carboxamide Openeye Name: 4-bromo-N-(3-ethynylphenyl)-1-propyl-pyrrole-2-carboxamide CAS Name: 4-bromo-N-(3-ethynylphenyl)-1-propyl-2-pyrrolecarboxamide IUPAC Name: 4-bromo-N-(3-ethynylphenyl)-1-propylpyrrole-2-carboxamide Traditional Name: 4-bromo-N-(3-ethynylphenyl)-1-propyl-pyrrole-2-carboxamide Formula: C16H15BrN2O MolecularWeight: 331.2071

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C=C1C(=O)NC2=CC=CC(=C2)C#C)Br

Isomeric SMILES

CCCN1C=C(C=C1C(=O)NC2=CC=CC(=C2)C#C)Br

InChI

InChI=1S/C16H15BrN2O/c1-3-8-19-11-13(17)10-15(19)16(20)18-14-7-5-6-12(4-2)9-14/h2,5-7,9-11H,3,8H2,1H3,(H,18,20)