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

Systemtic Name: ethyl 6-bromanyl-1-butyl-4-(dimethylaminomethyl)-2-methyl-5-oxidanyl-indole-3-carboxylate Openeye Name: ethyl 6-bromo-1-butyl-4-(dimethylaminomethyl)-5-hydroxy-2-methyl-indole-3-carboxylate CAS Name: 6-bromo-1-butyl-4-(dimethylaminomethyl)-5-hydroxy-2-methyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-1-butyl-4-(dimethylaminomethyl)-5-hydroxy-2-methylindole-3-carboxylate Traditional Name: 6-bromo-1-butyl-4-(dimethylaminomethyl)-5-hydroxy-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C19H27BrN2O3 MolecularWeight: 411.33328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=C(C(=C(C=C21)Br)O)CN(C)C)C(=O)OCC)C

Isomeric SMILES

CCCCN1C(=C(C2=C(C(=C(C=C21)Br)O)CN(C)C)C(=O)OCC)C

InChI

InChI=1S/C19H27BrN2O3/c1-6-8-9-22-12(3)16(19(24)25-7-2)17-13(11-21(4)5)18(23)14(20)10-15(17)22/h10,23H,6-9,11H2,1-5H3