4-(4-bromanyl-1H-indol-3-yl)butanoate

Systemtic Name: 4-(4-bromanyl-1H-indol-3-yl)butanoate Openeye Name: 4-(4-bromo-1H-indol-3-yl)butanoate CAS Name: 4-(4-bromo-1H-indol-3-yl)butanoate IUPAC Name: 4-(4-bromo-1H-indol-3-yl)butanoate Traditional Name: 4-(4-bromo-1H-indol-3-yl)butyrate Formula: C12H11BrNO2- MolecularWeight: 281.12524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Br)C(=CN2)CCCC(=O)[O-]

Isomeric SMILES

C1=CC2=C(C(=C1)Br)C(=CN2)CCCC(=O)[O-]

InChI

InChI=1S/C12H12BrNO2/c13-9-4-2-5-10-12(9)8(7-14-10)3-1-6-11(15)16/h2,4-5,7,14H,1,3,6H2,(H,15,16)/p-1