ethyl 6-bromanyl-1-(3-chlorophenyl)-4-(dimethylaminomethyl)-2-methyl-5-oxidanyl-indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-1-(3-chlorophenyl)-4-(dimethylaminomethyl)-2-methyl-5-oxidanyl-indole-3-carboxylate Openeye Name: ethyl 6-bromo-1-(3-chlorophenyl)-4-(dimethylaminomethyl)-5-hydroxy-2-methyl-indole-3-carboxylate CAS Name: 6-bromo-1-(3-chlorophenyl)-4-(dimethylaminomethyl)-5-hydroxy-2-methyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-1-(3-chlorophenyl)-4-(dimethylaminomethyl)-5-hydroxy-2-methylindole-3-carboxylate Traditional Name: 6-bromo-1-(3-chlorophenyl)-4-(dimethylaminomethyl)-5-hydroxy-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C21H22BrClN2O3 MolecularWeight: 465.76798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN(C)C)O)Br)C3=CC(=CC=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN(C)C)O)Br)C3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C21H22BrClN2O3/c1-5-28-21(27)18-12(2)25(14-8-6-7-13(23)9-14)17-10-16(22)20(26)15(19(17)18)11-24(3)4/h6-10,26H,5,11H2,1-4H3