2-[[4-(benzimidazol-1-yl)-2-methyl-butyl]amino]-1-(2-fluoranyl-4-phenylmethoxy-phenyl)ethanol

Systemtic Name: 2-[[4-(benzimidazol-1-yl)-2-methyl-butyl]amino]-1-(2-fluoranyl-4-phenylmethoxy-phenyl)ethanol Openeye Name: 2-[[4-(benzimidazol-1-yl)-2-methyl-butyl]amino]-1-(4-benzyloxy-2-fluoro-phenyl)ethanol CAS Name: 2-[[4-(1-benzimidazolyl)-2-methylbutyl]amino]-1-(2-fluoro-4-phenylmethoxyphenyl)ethanol IUPAC Name: 2-[[4-(benzimidazol-1-yl)-2-methylbutyl]amino]-1-(2-fluoro-4-phenylmethoxyphenyl)ethanol Traditional Name: 2-[[4-(benzimidazol-1-yl)-2-methyl-butyl]amino]-1-(4-benzoxy-2-fluoro-phenyl)ethanol Formula: C27H30FN3O2 MolecularWeight: 447.544403

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1C=NC2=CC=CC=C21)CNCC(C3=C(C=C(C=C3)OCC4=CC=CC=C4)F)O

Isomeric SMILES

CC(CCN1C=NC2=CC=CC=C21)CNCC(C3=C(C=C(C=C3)OCC4=CC=CC=C4)F)O

InChI

InChI=1S/C27H30FN3O2/c1-20(13-14-31-19-30-25-9-5-6-10-26(25)31)16-29-17-27(32)23-12-11-22(15-24(23)28)33-18-21-7-3-2-4-8-21/h2-12,15,19-20,27,29,32H,13-14,16-18H2,1H3