3-methoxy-4-[3-(methylamino)-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: 3-methoxy-4-[3-(methylamino)-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 4-[2-hydroxy-3-(methylamino)propoxy]-3-methoxy-benzonitrile CAS Name: 4-[2-hydroxy-3-(methylamino)propoxy]-3-methoxybenzonitrile IUPAC Name: 4-[2-hydroxy-3-(methylamino)propoxy]-3-methoxybenzonitrile Traditional Name: 4-[2-hydroxy-3-(methylamino)propoxy]-3-methoxy-benzonitrile Formula: C12H16N2O3 MolecularWeight: 236.26704

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Descriptors Computed from Structure

Canonical SMILES:

CNCC(COC1=C(C=C(C=C1)C#N)OC)O

Isomeric SMILES

CNCC(COC1=C(C=C(C=C1)C#N)OC)O

InChI

InChI=1S/C12H16N2O3/c1-14-7-10(15)8-17-11-4-3-9(6-13)5-12(11)16-2/h3-5,10,14-15H,7-8H2,1-2H3