3-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]methyl]benzenecarbonitrile hydrochloride

Systemtic Name: 3-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]methyl]benzenecarbonitrile hydrochloride Openeye Name: 3-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]methyl]benzonitrile hydrochloride CAS Name: 3-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]methyl]benzonitrile hydrochloride IUPAC Name: 3-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]methyl]benzonitrile hydrochloride Traditional Name: 3-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]methyl]benzonitrile hydrochloride Formula: C18H19ClN2O2 MolecularWeight: 330.80866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)NCC3=CC=CC(=C3)C#N.Cl

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCO2)NCC3=CC=CC(=C3)C#N.Cl

InChI

InChI=1S/C18H18N2O2.ClH/c1-13(20-12-15-4-2-3-14(9-15)11-19)16-5-6-17-18(10-16)22-8-7-21-17;/h2-6,9-10,13,20H,7-8,12H2,1H3;1H