2,6-ditert-butyl-4-[1-ethoxy-1-(1,3-oxazol-4-yl)-3,4-dihydroisoquinolin-2-yl]phenol

Systemtic Name: 2,6-ditert-butyl-4-[1-ethoxy-1-(1,3-oxazol-4-yl)-3,4-dihydroisoquinolin-2-yl]phenol Openeye Name: 2,6-ditert-butyl-4-(1-ethoxy-1-oxazol-4-yl-3,4-dihydroisoquinolin-2-yl)phenol CAS Name: 2,6-ditert-butyl-4-[1-ethoxy-1-(4-oxazolyl)-3,4-dihydroisoquinolin-2-yl]phenol IUPAC Name: 2,6-ditert-butyl-4-[1-ethoxy-1-(1,3-oxazol-4-yl)-3,4-dihydroisoquinolin-2-yl]phenol Traditional Name: 2,6-ditert-butyl-4-(1-ethoxy-1-oxazol-4-yl-3,4-dihydroisoquinolin-2-yl)phenol Formula: C28H36N2O3 MolecularWeight: 448.59704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1(C2=CC=CC=C2CCN1C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C4=COC=N4

Isomeric SMILES

CCOC1(C2=CC=CC=C2CCN1C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C4=COC=N4

InChI

InChI=1S/C28H36N2O3/c1-8-33-28(24-17-32-18-29-24)21-12-10-9-11-19(21)13-14-30(28)20-15-22(26(2,3)4)25(31)23(16-20)27(5,6)7/h9-12,15-18,31H,8,13-14H2,1-7H3