2-azanyl-4-[2-(3-azanyl-4-oxidanyl-phenyl)-5,7-diethyl-2-adamantyl]phenol

Systemtic Name: 2-azanyl-4-[2-(3-azanyl-4-oxidanyl-phenyl)-5,7-diethyl-2-adamantyl]phenol Openeye Name: 2-amino-4-[2-(3-amino-4-hydroxy-phenyl)-5,7-diethyl-2-adamantyl]phenol CAS Name: 2-amino-4-[2-(3-amino-4-hydroxyphenyl)-5,7-diethyl-2-adamantyl]phenol IUPAC Name: 2-amino-4-[2-(3-amino-4-hydroxyphenyl)-5,7-diethyl-2-adamantyl]phenol Traditional Name: 2-amino-4-[2-(3-amino-4-hydroxy-phenyl)-5,7-diethyl-2-adamantyl]phenol Formula: C26H34N2O2 MolecularWeight: 406.56036

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Descriptors Computed from Structure

Canonical SMILES:

CCC12CC3CC(C1)(CC(C2)C3(C4=CC(=C(C=C4)O)N)C5=CC(=C(C=C5)O)N)CC

Isomeric SMILES

CCC12CC3CC(C1)(CC(C2)C3(C4=CC(=C(C=C4)O)N)C5=CC(=C(C=C5)O)N)CC

InChI

InChI=1S/C26H34N2O2/c1-3-24-11-18-13-25(4-2,15-24)14-19(12-24)26(18,16-5-7-22(29)20(27)9-16)17-6-8-23(30)21(28)10-17/h5-10,18-19,29-30H,3-4,11-15,27-28H2,1-2H3