2,2-dimethyl-4-[[3-methyl-3-oxidanyl-1-(4-phenylmethoxyphenyl)butan-2-yl]amino]-3,4-dihydrochromen-3-ol

Systemtic Name: 2,2-dimethyl-4-[[3-methyl-3-oxidanyl-1-(4-phenylmethoxyphenyl)butan-2-yl]amino]-3,4-dihydrochromen-3-ol Openeye Name: 4-[[1-[(4-benzyloxyphenyl)methyl]-2-hydroxy-2-methyl-propyl]amino]-2,2-dimethyl-chroman-3-ol CAS Name: 4-[[3-hydroxy-3-methyl-1-(4-phenylmethoxyphenyl)butan-2-yl]amino]-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-3-ol IUPAC Name: 4-[[3-hydroxy-3-methyl-1-(4-phenylmethoxyphenyl)butan-2-yl]amino]-2,2-dimethyl-3,4-dihydrochromen-3-ol Traditional Name: 4-[[1-(4-benzoxybenzyl)-2-hydroxy-2-methyl-propyl]amino]-2,2-dimethyl-chroman-3-ol Formula: C29H35NO4 MolecularWeight: 461.5925

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=CC=CC=C2O1)NC(CC3=CC=C(C=C3)OCC4=CC=CC=C4)C(C)(C)O)O)C

Isomeric SMILES

CC1(C(C(C2=CC=CC=C2O1)NC(CC3=CC=C(C=C3)OCC4=CC=CC=C4)C(C)(C)O)O)C

InChI

InChI=1S/C29H35NO4/c1-28(2,32)25(30-26-23-12-8-9-13-24(23)34-29(3,4)27(26)31)18-20-14-16-22(17-15-20)33-19-21-10-6-5-7-11-21/h5-17,25-27,30-32H,18-19H2,1-4H3