4-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylamino]benzenecarbonitrile

Systemtic Name: 4-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylamino]benzenecarbonitrile Openeye Name: 4-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylamino]benzonitrile CAS Name: 4-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylamino]benzonitrile IUPAC Name: 4-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylamino]benzonitrile Traditional Name: 4-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylamino]benzonitrile Formula: C18H18N2O2 MolecularWeight: 294.34772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCCO2)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCCO2)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H18N2O2/c1-13(20-16-6-3-14(12-19)4-7-16)15-5-8-17-18(11-15)22-10-2-9-21-17/h3-8,11,13,20H,2,9-10H2,1H3