ethyl 5-[2-(4-bromophenyl)-2-oxidanylidene-ethoxy]-1,2-dimethyl-indole-3-carboxylate

Systemtic Name: ethyl 5-[2-(4-bromophenyl)-2-oxidanylidene-ethoxy]-1,2-dimethyl-indole-3-carboxylate Openeye Name: ethyl 5-[2-(4-bromophenyl)-2-oxo-ethoxy]-1,2-dimethyl-indole-3-carboxylate CAS Name: 5-[2-(4-bromophenyl)-2-oxoethoxy]-1,2-dimethyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(4-bromophenyl)-2-oxoethoxy]-1,2-dimethylindole-3-carboxylate Traditional Name: 5-[2-(4-bromophenyl)-2-keto-ethoxy]-1,2-dimethyl-indole-3-carboxylic acid ethyl ester Formula: C21H20BrNO4 MolecularWeight: 430.2918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(=O)C3=CC=C(C=C3)Br)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(=O)C3=CC=C(C=C3)Br)C)C

InChI

InChI=1S/C21H20BrNO4/c1-4-26-21(25)20-13(2)23(3)18-10-9-16(11-17(18)20)27-12-19(24)14-5-7-15(22)8-6-14/h5-11H,4,12H2,1-3H3