2-[2,2-dimethyl-5-oxidanyl-7-(5-phenylpentan-2-yloxy)-3,4-dihydrochromen-4-yl]ethanenitrile

Systemtic Name: 2-[2,2-dimethyl-5-oxidanyl-7-(5-phenylpentan-2-yloxy)-3,4-dihydrochromen-4-yl]ethanenitrile Openeye Name: 2-[5-hydroxy-2,2-dimethyl-7-(1-methyl-4-phenyl-butoxy)chroman-4-yl]acetonitrile CAS Name: 2-[5-hydroxy-2,2-dimethyl-7-(5-phenylpentan-2-yloxy)-3,4-dihydro-2H-1-benzopyran-4-yl]acetonitrile IUPAC Name: 2-[5-hydroxy-2,2-dimethyl-7-(5-phenylpentan-2-yloxy)-3,4-dihydrochromen-4-yl]acetonitrile Traditional Name: 2-[5-hydroxy-2,2-dimethyl-7-(1-methyl-4-phenyl-butoxy)chroman-4-yl]acetonitrile Formula: C24H29NO3 MolecularWeight: 379.49196

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=CC=CC=C1)OC2=CC(=C3C(CC(OC3=C2)(C)C)CC#N)O

Isomeric SMILES

CC(CCCC1=CC=CC=C1)OC2=CC(=C3C(CC(OC3=C2)(C)C)CC#N)O

InChI

InChI=1S/C24H29NO3/c1-17(8-7-11-18-9-5-4-6-10-18)27-20-14-21(26)23-19(12-13-25)16-24(2,3)28-22(23)15-20/h4-6,9-10,14-15,17,19,26H,7-8,11-12,16H2,1-3H3