4-[[(4R)-3-[2-(1-adamantyl)ethyl]-2-azanyl-4,5-dihydroimidazol-4-yl]methyl]phenol

Systemtic Name: 4-[[(4R)-3-[2-(1-adamantyl)ethyl]-2-azanyl-4,5-dihydroimidazol-4-yl]methyl]phenol Openeye Name: 4-[[(4R)-3-[2-(1-adamantyl)ethyl]-2-amino-4,5-dihydroimidazol-4-yl]methyl]phenol CAS Name: 4-[[(4R)-3-[2-(1-adamantyl)ethyl]-2-amino-4,5-dihydroimidazol-4-yl]methyl]phenol IUPAC Name: 4-[[(4R)-3-[2-(1-adamantyl)ethyl]-2-amino-4,5-dihydroimidazol-4-yl]methyl]phenol Traditional Name: 4-[[(4R)-3-[2-(1-adamantyl)ethyl]-2-amino-2-imidazolin-4-yl]methyl]phenol Formula: C22H31N3O MolecularWeight: 353.50104

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CCN4C(CN=C4N)CC5=CC=C(C=C5)O

Isomeric SMILES

C1[C@H](N(C(=N1)N)CCC23CC4CC(C2)CC(C4)C3)CC5=CC=C(C=C5)O

InChI

InChI=1S/C22H31N3O/c23-21-24-14-19(10-15-1-3-20(26)4-2-15)25(21)6-5-22-11-16-7-17(12-22)9-18(8-16)13-22/h1-4,16-19,26H,5-14H2,(H2,23,24)/t16?,17?,18?,19-,22?/m1/s1