4-[2-(3-imidazol-1-ylpropylamino)propan-2-yl]-2-pentyl-phenol

Systemtic Name: 4-[2-(3-imidazol-1-ylpropylamino)propan-2-yl]-2-pentyl-phenol Openeye Name: 4-[1-(3-imidazol-1-ylpropylamino)-1-methyl-ethyl]-2-pentyl-phenol CAS Name: 4-[2-[3-(1-imidazolyl)propylamino]propan-2-yl]-2-pentylphenol IUPAC Name: 4-[2-(3-imidazol-1-ylpropylamino)propan-2-yl]-2-pentylphenol Traditional Name: 2-amyl-4-[1-(3-imidazol-1-ylpropylamino)-1-methyl-ethyl]phenol Formula: C20H31N3O MolecularWeight: 329.47964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=CC(=C1)C(C)(C)NCCCN2C=CN=C2)O

Isomeric SMILES

CCCCCC1=C(C=CC(=C1)C(C)(C)NCCCN2C=CN=C2)O

InChI

InChI=1S/C20H31N3O/c1-4-5-6-8-17-15-18(9-10-19(17)24)20(2,3)22-11-7-13-23-14-12-21-16-23/h9-10,12,14-16,22,24H,4-8,11,13H2,1-3H3