3-bromanyl-4-[3-(dimethylamino)propoxy]-5-methoxy-benzenecarbonitrile

Systemtic Name: 3-bromanyl-4-[3-(dimethylamino)propoxy]-5-methoxy-benzenecarbonitrile Openeye Name: 3-bromo-4-[3-(dimethylamino)propoxy]-5-methoxy-benzonitrile CAS Name: 3-bromo-4-[3-(dimethylamino)propoxy]-5-methoxybenzonitrile IUPAC Name: 3-bromo-4-[3-(dimethylamino)propoxy]-5-methoxybenzonitrile Traditional Name: 3-bromo-4-[3-(dimethylamino)propoxy]-5-methoxy-benzonitrile Formula: C13H17BrN2O2 MolecularWeight: 313.19028

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=C(C=C(C=C1Br)C#N)OC

Isomeric SMILES

CN(C)CCCOC1=C(C=C(C=C1Br)C#N)OC

InChI

InChI=1S/C13H17BrN2O2/c1-16(2)5-4-6-18-13-11(14)7-10(9-15)8-12(13)17-3/h7-8H,4-6H2,1-3H3