2-[2-[(4-bromanyl-2-cyano-phenoxy)methyl]-1-methyl-indol-3-yl]-N-[3-(dimethylamino)propyl]-N-methyl-2-oxidanylidene-ethanamide

Systemtic Name: 2-[2-[(4-bromanyl-2-cyano-phenoxy)methyl]-1-methyl-indol-3-yl]-N-[3-(dimethylamino)propyl]-N-methyl-2-oxidanylidene-ethanamide Openeye Name: 2-[2-[(4-bromo-2-cyano-phenoxy)methyl]-1-methyl-indol-3-yl]-N-[3-(dimethylamino)propyl]-N-methyl-2-oxo-acetamide CAS Name: 2-[2-[(4-bromo-2-cyanophenoxy)methyl]-1-methyl-3-indolyl]-N-[3-(dimethylamino)propyl]-N-methyl-2-oxoacetamide IUPAC Name: 2-[2-[(4-bromo-2-cyanophenoxy)methyl]-1-methylindol-3-yl]-N-[3-(dimethylamino)propyl]-N-methyl-2-oxoacetamide Traditional Name: 2-[2-[(4-bromo-2-cyano-phenoxy)methyl]-1-methyl-indol-3-yl]-N-[3-(dimethylamino)propyl]-2-keto-N-methyl-acetamide Formula: C25H27BrN4O3 MolecularWeight: 511.41088

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1COC3=C(C=C(C=C3)Br)C#N)C(=O)C(=O)N(C)CCCN(C)C

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1COC3=C(C=C(C=C3)Br)C#N)C(=O)C(=O)N(C)CCCN(C)C

InChI

InChI=1S/C25H27BrN4O3/c1-28(2)12-7-13-29(3)25(32)24(31)23-19-8-5-6-9-20(19)30(4)21(23)16-33-22-11-10-18(26)14-17(22)15-27/h5-6,8-11,14H,7,12-13,16H2,1-4H3