2-chloranyl-6-[3-[[1-(2,3-dihydro-1-benzofuran-5-yl)-2-methyl-propan-2-yl]amino]-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: 2-chloranyl-6-[3-[[1-(2,3-dihydro-1-benzofuran-5-yl)-2-methyl-propan-2-yl]amino]-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 2-chloro-6-[3-[[2-(2,3-dihydrobenzofuran-5-yl)-1,1-dimethyl-ethyl]amino]-2-hydroxy-propoxy]benzonitrile CAS Name: 2-chloro-6-[3-[[1-(2,3-dihydrobenzofuran-5-yl)-2-methylpropan-2-yl]amino]-2-hydroxypropoxy]benzonitrile IUPAC Name: 2-chloro-6-[3-[[1-(2,3-dihydro-1-benzofuran-5-yl)-2-methylpropan-2-yl]amino]-2-hydroxypropoxy]benzonitrile Traditional Name: 2-chloro-6-[3-[(2-coumaran-5-yl-1,1-dimethyl-ethyl)amino]-2-hydroxy-propoxy]benzonitrile Formula: C22H25ClN2O3 MolecularWeight: 400.8985

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC2=C(C=C1)OCC2)NCC(COC3=C(C(=CC=C3)Cl)C#N)O

Isomeric SMILES

CC(C)(CC1=CC2=C(C=C1)OCC2)NCC(COC3=C(C(=CC=C3)Cl)C#N)O

InChI

InChI=1S/C22H25ClN2O3/c1-22(2,11-15-6-7-20-16(10-15)8-9-27-20)25-13-17(26)14-28-21-5-3-4-19(23)18(21)12-24/h3-7,10,17,25-26H,8-9,11,13-14H2,1-2H3