2-[4-(3-azanylpropoxy)-3,5-bis(bromanyl)phenyl]ethyl-methyl-cyanamide

Systemtic Name: 2-[4-(3-azanylpropoxy)-3,5-bis(bromanyl)phenyl]ethyl-methyl-cyanamide Openeye Name: 2-[4-(3-aminopropoxy)-3,5-dibromo-phenyl]ethyl-methyl-cyanamide CAS Name: 2-[4-(3-aminopropoxy)-3,5-dibromophenyl]ethyl-methylcyanamide IUPAC Name: 2-[4-(3-aminopropoxy)-3,5-dibromophenyl]ethyl-methylcyanamide Traditional Name: 2-[4-(3-aminopropoxy)-3,5-dibromo-phenyl]ethyl-methyl-cyanamide Formula: C13H17Br2N3O MolecularWeight: 391.10158

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C(=C1)Br)OCCCN)Br)C#N

Isomeric SMILES

CN(CCC1=CC(=C(C(=C1)Br)OCCCN)Br)C#N

InChI

InChI=1S/C13H17Br2N3O/c1-18(9-17)5-3-10-7-11(14)13(12(15)8-10)19-6-2-4-16/h7-8H,2-6,16H2,1H3