ethyl 6-bromanyl-2-[(2-diethylaminoethylamino)methyl]-1-methyl-5-oxidanyl-indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-2-[(2-diethylaminoethylamino)methyl]-1-methyl-5-oxidanyl-indole-3-carboxylate Openeye Name: ethyl 6-bromo-2-[(2-diethylaminoethylamino)methyl]-5-hydroxy-1-methyl-indole-3-carboxylate CAS Name: 6-bromo-2-[(2-diethylaminoethylamino)methyl]-5-hydroxy-1-methyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-2-[(2-diethylaminoethylamino)methyl]-5-hydroxy-1-methylindole-3-carboxylate Traditional Name: 6-bromo-2-[(2-diethylaminoethylamino)methyl]-5-hydroxy-1-methyl-indole-3-carboxylic acid ethyl ester Formula: C19H28BrN3O3 MolecularWeight: 426.34792

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNCC1=C(C2=CC(=C(C=C2N1C)Br)O)C(=O)OCC

Isomeric SMILES

CCN(CC)CCNCC1=C(C2=CC(=C(C=C2N1C)Br)O)C(=O)OCC

InChI

InChI=1S/C19H28BrN3O3/c1-5-23(6-2)9-8-21-12-16-18(19(25)26-7-3)13-10-17(24)14(20)11-15(13)22(16)4/h10-11,21,24H,5-9,12H2,1-4H3