4,5-bis(bromanyl)-N-[3-(diethylamino)-2-oxidanyl-propyl]-3-methoxy-1-phenyl-indole-2-carboxamide

Systemtic Name: 4,5-bis(bromanyl)-N-[3-(diethylamino)-2-oxidanyl-propyl]-3-methoxy-1-phenyl-indole-2-carboxamide Openeye Name: 4,5-dibromo-N-[3-(diethylamino)-2-hydroxy-propyl]-3-methoxy-1-phenyl-indole-2-carboxamide CAS Name: 4,5-dibromo-N-[3-(diethylamino)-2-hydroxypropyl]-3-methoxy-1-phenyl-2-indolecarboxamide IUPAC Name: 4,5-dibromo-N-[3-(diethylamino)-2-hydroxypropyl]-3-methoxy-1-phenylindole-2-carboxamide Traditional Name: 4,5-dibromo-N-[3-(diethylamino)-2-hydroxy-propyl]-3-methoxy-1-phenyl-indole-2-carboxamide Formula: C23H27Br2N3O3 MolecularWeight: 553.28678

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(CNC(=O)C1=C(C2=C(N1C3=CC=CC=C3)C=CC(=C2Br)Br)OC)O

Isomeric SMILES

CCN(CC)CC(CNC(=O)C1=C(C2=C(N1C3=CC=CC=C3)C=CC(=C2Br)Br)OC)O

InChI

InChI=1S/C23H27Br2N3O3/c1-4-27(5-2)14-16(29)13-26-23(30)21-22(31-3)19-18(12-11-17(24)20(19)25)28(21)15-9-7-6-8-10-15/h6-12,16,29H,4-5,13-14H2,1-3H3,(H,26,30)