2-[5-bromanyl-2-(2,5-dimethylthiophen-3-yl)-1H-indol-3-yl]ethanoate

Systemtic Name: 2-[5-bromanyl-2-(2,5-dimethylthiophen-3-yl)-1H-indol-3-yl]ethanoate Openeye Name: 2-[5-bromo-2-(2,5-dimethyl-3-thienyl)-1H-indol-3-yl]acetate CAS Name: 2-[5-bromo-2-(2,5-dimethyl-3-thiophenyl)-1H-indol-3-yl]acetate IUPAC Name: 2-[5-bromo-2-(2,5-dimethylthiophen-3-yl)-1H-indol-3-yl]acetate Traditional Name: 2-[5-bromo-2-(2,5-dimethyl-3-thienyl)-1H-indol-3-yl]acetate Formula: C16H13BrNO2S- MolecularWeight: 363.24892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C2=C(C3=C(N2)C=CC(=C3)Br)CC(=O)[O-]

Isomeric SMILES

CC1=CC(=C(S1)C)C2=C(C3=C(N2)C=CC(=C3)Br)CC(=O)[O-]

InChI

InChI=1S/C16H14BrNO2S/c1-8-5-11(9(2)21-8)16-13(7-15(19)20)12-6-10(17)3-4-14(12)18-16/h3-6,18H,7H2,1-2H3,(H,19,20)/p-1