ethyl 5-acetyloxy-6-bromanyl-2-(bromomethyl)-1-(4-methoxyphenyl)indole-3-carboxylate

Systemtic Name: ethyl 5-acetyloxy-6-bromanyl-2-(bromomethyl)-1-(4-methoxyphenyl)indole-3-carboxylate Openeye Name: ethyl 5-acetoxy-6-bromo-2-(bromomethyl)-1-(4-methoxyphenyl)indole-3-carboxylate CAS Name: 5-acetyloxy-6-bromo-2-(bromomethyl)-1-(4-methoxyphenyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyloxy-6-bromo-2-(bromomethyl)-1-(4-methoxyphenyl)indole-3-carboxylate Traditional Name: 5-acetoxy-6-bromo-2-(bromomethyl)-1-(4-methoxyphenyl)indole-3-carboxylic acid ethyl ester Formula: C21H19Br2NO5 MolecularWeight: 525.18726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC(=O)C)Br)C3=CC=C(C=C3)OC)CBr

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC(=O)C)Br)C3=CC=C(C=C3)OC)CBr

InChI

InChI=1S/C21H19Br2NO5/c1-4-28-21(26)20-15-9-19(29-12(2)25)16(23)10-17(15)24(18(20)11-22)13-5-7-14(27-3)8-6-13/h5-10H,4,11H2,1-3H3