(2-bromanyl-4,5-dimethoxy-phenyl)methyl 1H-indole-3-carboxylate

Systemtic Name: (2-bromanyl-4,5-dimethoxy-phenyl)methyl 1H-indole-3-carboxylate Openeye Name: (2-bromo-4,5-dimethoxy-phenyl)methyl 1H-indole-3-carboxylate CAS Name: 1H-indole-3-carboxylic acid (2-bromo-4,5-dimethoxyphenyl)methyl ester IUPAC Name: (2-bromo-4,5-dimethoxyphenyl)methyl 1H-indole-3-carboxylate Traditional Name: 1H-indole-3-carboxylic acid (2-bromo-4,5-dimethoxy-benzyl) ester Formula: C18H16BrNO4 MolecularWeight: 390.22794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)COC(=O)C2=CNC3=CC=CC=C32)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)COC(=O)C2=CNC3=CC=CC=C32)Br)OC

InChI

InChI=1S/C18H16BrNO4/c1-22-16-7-11(14(19)8-17(16)23-2)10-24-18(21)13-9-20-15-6-4-3-5-12(13)15/h3-9,20H,10H2,1-2H3