2,6-ditert-butyl-4-[3-[4-[(3-isoquinolin-7-yloxy-2-oxidanyl-propyl)amino]phenoxy]propyl]phenol

Systemtic Name: 2,6-ditert-butyl-4-[3-[4-[(3-isoquinolin-7-yloxy-2-oxidanyl-propyl)amino]phenoxy]propyl]phenol Openeye Name: 2,6-ditert-butyl-4-[3-[4-[[2-hydroxy-3-(7-isoquinolyloxy)propyl]amino]phenoxy]propyl]phenol CAS Name: 2,6-ditert-butyl-4-[3-[4-[[2-hydroxy-3-(7-isoquinolinyloxy)propyl]amino]phenoxy]propyl]phenol IUPAC Name: 2,6-ditert-butyl-4-[3-[4-[(2-hydroxy-3-isoquinolin-7-yloxypropyl)amino]phenoxy]propyl]phenol Traditional Name: 2,6-ditert-butyl-4-[3-[4-[[2-hydroxy-3-(7-isoquinolyloxy)propyl]amino]phenoxy]propyl]phenol Formula: C35H44N2O4 MolecularWeight: 556.73486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCOC2=CC=C(C=C2)NCC(COC3=CC4=C(C=C3)C=CN=C4)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCOC2=CC=C(C=C2)NCC(COC3=CC4=C(C=C3)C=CN=C4)O

InChI

InChI=1S/C35H44N2O4/c1-34(2,3)31-18-24(19-32(33(31)39)35(4,5)6)8-7-17-40-29-13-10-27(11-14-29)37-22-28(38)23-41-30-12-9-25-15-16-36-21-26(25)20-30/h9-16,18-21,28,37-39H,7-8,17,22-23H2,1-6H3