4-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)methyl]benzenecarbonitrile

Systemtic Name: 4-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)methyl]benzenecarbonitrile Openeye Name: 4-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)methyl]benzonitrile CAS Name: 4-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)methyl]benzonitrile IUPAC Name: 4-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)methyl]benzonitrile Traditional Name: 4-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)methyl]benzonitrile Formula: C17H16N2O2 MolecularWeight: 280.32114

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CNCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CNCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H16N2O2/c18-10-13-1-3-14(4-2-13)11-19-12-15-5-6-16-17(9-15)21-8-7-20-16/h1-6,9,19H,7-8,11-12H2