(5-bromanyl-4-chloranyl-1H-indol-3-yl) octanoate

Systemtic Name: (5-bromanyl-4-chloranyl-1H-indol-3-yl) octanoate Openeye Name: (5-bromo-4-chloro-1H-indol-3-yl) octanoate CAS Name: octanoic acid (5-bromo-4-chloro-1H-indol-3-yl) ester IUPAC Name: (5-bromo-4-chloro-1H-indol-3-yl) octanoate Traditional Name: caprylic acid (5-bromo-4-chloro-1H-indol-3-yl) ester Formula: C16H19BrClNO2 MolecularWeight: 372.68456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=CNC2=C1C(=C(C=C2)Br)Cl

Isomeric SMILES

CCCCCCCC(=O)OC1=CNC2=C1C(=C(C=C2)Br)Cl

InChI

InChI=1S/C16H19BrClNO2/c1-2-3-4-5-6-7-14(20)21-13-10-19-12-9-8-11(17)16(18)15(12)13/h8-10,19H,2-7H2,1H3