2-azanyl-4-[3-(3-azanyl-5-ethoxy-4-oxidanyl-phenyl)-1-adamantyl]-6-ethoxy-phenol

Systemtic Name: 2-azanyl-4-[3-(3-azanyl-5-ethoxy-4-oxidanyl-phenyl)-1-adamantyl]-6-ethoxy-phenol Openeye Name: 2-amino-4-[3-(3-amino-5-ethoxy-4-hydroxy-phenyl)-1-adamantyl]-6-ethoxy-phenol CAS Name: 2-amino-4-[3-(3-amino-5-ethoxy-4-hydroxyphenyl)-1-adamantyl]-6-ethoxyphenol IUPAC Name: 2-amino-4-[3-(3-amino-5-ethoxy-4-hydroxyphenyl)-1-adamantyl]-6-ethoxyphenol Traditional Name: 2-amino-4-[3-(3-amino-5-ethoxy-4-hydroxy-phenyl)-1-adamantyl]-6-ethoxy-phenol Formula: C26H34N2O4 MolecularWeight: 438.55916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1O)N)C23CC4CC(C2)CC(C4)(C3)C5=CC(=C(C(=C5)OCC)O)N

Isomeric SMILES

CCOC1=CC(=CC(=C1O)N)C23CC4CC(C2)CC(C4)(C3)C5=CC(=C(C(=C5)OCC)O)N

InChI

InChI=1S/C26H34N2O4/c1-3-31-21-8-17(6-19(27)23(21)29)25-10-15-5-16(11-25)13-26(12-15,14-25)18-7-20(28)24(30)22(9-18)32-4-2/h6-9,15-16,29-30H,3-5,10-14,27-28H2,1-2H3