ethyl 6-bromanyl-2-(2-cyano-2,2-diphenyl-ethyl)-5-methoxy-1-methyl-indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-2-(2-cyano-2,2-diphenyl-ethyl)-5-methoxy-1-methyl-indole-3-carboxylate Openeye Name: ethyl 6-bromo-2-(2-cyano-2,2-diphenyl-ethyl)-5-methoxy-1-methyl-indole-3-carboxylate CAS Name: 6-bromo-2-(2-cyano-2,2-diphenylethyl)-5-methoxy-1-methyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-2-(2-cyano-2,2-diphenylethyl)-5-methoxy-1-methylindole-3-carboxylate Traditional Name: 6-bromo-2-(2-cyano-2,2-diphenyl-ethyl)-5-methoxy-1-methyl-indole-3-carboxylic acid ethyl ester Formula: C28H25BrN2O3 MolecularWeight: 517.4137

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C)CC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C)CC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H25BrN2O3/c1-4-34-27(32)26-21-15-25(33-3)22(29)16-23(21)31(2)24(26)17-28(18-30,19-11-7-5-8-12-19)20-13-9-6-10-14-20/h5-16H,4,17H2,1-3H3