4-[1-(2,3-dihydro-1-benzofuran-5-ylmethylamino)ethyl]benzenecarbonitrile

Systemtic Name: 4-[1-(2,3-dihydro-1-benzofuran-5-ylmethylamino)ethyl]benzenecarbonitrile Openeye Name: 4-[1-(2,3-dihydrobenzofuran-5-ylmethylamino)ethyl]benzonitrile CAS Name: 4-[1-(2,3-dihydrobenzofuran-5-ylmethylamino)ethyl]benzonitrile IUPAC Name: 4-[1-(2,3-dihydro-1-benzofuran-5-ylmethylamino)ethyl]benzonitrile Traditional Name: 4-[1-(coumaran-5-ylmethylamino)ethyl]benzonitrile Formula: C18H18N2O MolecularWeight: 278.34832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C#N)NCC2=CC3=C(C=C2)OCC3

Isomeric SMILES

CC(C1=CC=C(C=C1)C#N)NCC2=CC3=C(C=C2)OCC3

InChI

InChI=1S/C18H18N2O/c1-13(16-5-2-14(11-19)3-6-16)20-12-15-4-7-18-17(10-15)8-9-21-18/h2-7,10,13,20H,8-9,12H2,1H3