2,2-dimethyl-7-(2-methylpropyl)-5-phenylmethoxy-3,4-dihydrochromene-4-carbonitrile

Systemtic Name: 2,2-dimethyl-7-(2-methylpropyl)-5-phenylmethoxy-3,4-dihydrochromene-4-carbonitrile Openeye Name: 5-benzyloxy-7-isobutyl-2,2-dimethyl-chromane-4-carbonitrile CAS Name: 2,2-dimethyl-7-(2-methylpropyl)-5-phenylmethoxy-3,4-dihydro-2H-1-benzopyran-4-carbonitrile IUPAC Name: 2,2-dimethyl-7-(2-methylpropyl)-5-phenylmethoxy-3,4-dihydrochromene-4-carbonitrile Traditional Name: 5-benzoxy-7-isobutyl-2,2-dimethyl-chroman-4-carbonitrile Formula: C23H27NO2 MolecularWeight: 349.46598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC2=C(C(CC(O2)(C)C)C#N)C(=C1)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CC1=CC2=C(C(CC(O2)(C)C)C#N)C(=C1)OCC3=CC=CC=C3

InChI

InChI=1S/C23H27NO2/c1-16(2)10-18-11-20(25-15-17-8-6-5-7-9-17)22-19(14-24)13-23(3,4)26-21(22)12-18/h5-9,11-12,16,19H,10,13,15H2,1-4H3