methyl 5-bromanyl-3-(3,4,5-trimethoxyphenyl)carbonyl-1H-indole-2-carboxylate

Systemtic Name: methyl 5-bromanyl-3-(3,4,5-trimethoxyphenyl)carbonyl-1H-indole-2-carboxylate Openeye Name: methyl 5-bromo-3-(3,4,5-trimethoxybenzoyl)-1H-indole-2-carboxylate CAS Name: 5-bromo-3-[oxo-(3,4,5-trimethoxyphenyl)methyl]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-bromo-3-(3,4,5-trimethoxybenzoyl)-1H-indole-2-carboxylate Traditional Name: 5-bromo-3-(3,4,5-trimethoxybenzoyl)-1H-indole-2-carboxylic acid methyl ester Formula: C20H18BrNO6 MolecularWeight: 448.26402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)C2=C(NC3=C2C=C(C=C3)Br)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)C2=C(NC3=C2C=C(C=C3)Br)C(=O)OC

InChI

InChI=1S/C20H18BrNO6/c1-25-14-7-10(8-15(26-2)19(14)27-3)18(23)16-12-9-11(21)5-6-13(12)22-17(16)20(24)28-4/h5-9,22H,1-4H3