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

Systemtic Name: ethyl 6-bromanyl-2-[(2-diethylaminoethylamino)methyl]-5-methoxy-1-phenyl-indole-3-carboxylate Openeye Name: ethyl 6-bromo-2-[(2-diethylaminoethylamino)methyl]-5-methoxy-1-phenyl-indole-3-carboxylate CAS Name: 6-bromo-2-[(2-diethylaminoethylamino)methyl]-5-methoxy-1-phenyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-2-[(2-diethylaminoethylamino)methyl]-5-methoxy-1-phenylindole-3-carboxylate Traditional Name: 6-bromo-2-[(2-diethylaminoethylamino)methyl]-5-methoxy-1-phenyl-indole-3-carboxylic acid ethyl ester Formula: C25H32BrN3O3 MolecularWeight: 502.44388

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNCC1=C(C2=CC(=C(C=C2N1C3=CC=CC=C3)Br)OC)C(=O)OCC

Isomeric SMILES

CCN(CC)CCNCC1=C(C2=CC(=C(C=C2N1C3=CC=CC=C3)Br)OC)C(=O)OCC

InChI

InChI=1S/C25H32BrN3O3/c1-5-28(6-2)14-13-27-17-22-24(25(30)32-7-3)19-15-23(31-4)20(26)16-21(19)29(22)18-11-9-8-10-12-18/h8-12,15-16,27H,5-7,13-14,17H2,1-4H3