3-azanyl-5-(4-imidazol-1-ylphenoxy)-1-(3-methylphenoxy)pentan-2-ol

Systemtic Name: 3-azanyl-5-(4-imidazol-1-ylphenoxy)-1-(3-methylphenoxy)pentan-2-ol Openeye Name: 3-amino-5-(4-imidazol-1-ylphenoxy)-1-(3-methylphenoxy)pentan-2-ol CAS Name: 3-amino-5-[4-(1-imidazolyl)phenoxy]-1-(3-methylphenoxy)-2-pentanol IUPAC Name: 3-amino-5-(4-imidazol-1-ylphenoxy)-1-(3-methylphenoxy)pentan-2-ol Traditional Name: 3-amino-5-(4-imidazol-1-ylphenoxy)-1-(3-methylphenoxy)pentan-2-ol Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(C(CCOC2=CC=C(C=C2)N3C=CN=C3)N)O

Isomeric SMILES

CC1=CC(=CC=C1)OCC(C(CCOC2=CC=C(C=C2)N3C=CN=C3)N)O

InChI

InChI=1S/C21H25N3O3/c1-16-3-2-4-19(13-16)27-14-21(25)20(22)9-12-26-18-7-5-17(6-8-18)24-11-10-23-15-24/h2-8,10-11,13,15,20-21,25H,9,12,14,22H2,1H3