4-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-1-(4-tert-butylphenyl)butan-1-one

Systemtic Name: 4-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-1-(4-tert-butylphenyl)butan-1-one Openeye Name: 4-[4-(1,3-benzoxazol-2-yl)-1-piperidyl]-1-(4-tert-butylphenyl)butan-1-one CAS Name: 4-[4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-1-(4-tert-butylphenyl)-1-butanone IUPAC Name: 4-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-1-(4-tert-butylphenyl)butan-1-one Traditional Name: 4-[4-(1,3-benzoxazol-2-yl)piperidino]-1-(4-tert-butylphenyl)butan-1-one Formula: C26H32N2O2 MolecularWeight: 404.54448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCC(CC2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCC(CC2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C26H32N2O2/c1-26(2,3)21-12-10-19(11-13-21)23(29)8-6-16-28-17-14-20(15-18-28)25-27-22-7-4-5-9-24(22)30-25/h4-5,7,9-13,20H,6,8,14-18H2,1-3H3