7-[2-ethyl-4-(4-fluorophenyl)-5-phenylmethoxy-phenoxy]-2-methyl-heptan-2-amine

Systemtic Name: 7-[2-ethyl-4-(4-fluorophenyl)-5-phenylmethoxy-phenoxy]-2-methyl-heptan-2-amine Openeye Name: 7-[5-benzyloxy-2-ethyl-4-(4-fluorophenyl)phenoxy]-2-methyl-heptan-2-amine CAS Name: 7-[2-ethyl-4-(4-fluorophenyl)-5-phenylmethoxyphenoxy]-2-methyl-2-heptanamine IUPAC Name: 7-[2-ethyl-4-(4-fluorophenyl)-5-phenylmethoxyphenoxy]-2-methylheptan-2-amine Traditional Name: [6-[5-benzoxy-2-ethyl-4-(4-fluorophenyl)phenoxy]-1,1-dimethyl-hexyl]amine Formula: C29H36FNO2 MolecularWeight: 449.600043

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C2=CC=C(C=C2)F)OCC3=CC=CC=C3)OCCCCCC(C)(C)N

Isomeric SMILES

CCC1=C(C=C(C(=C1)C2=CC=C(C=C2)F)OCC3=CC=CC=C3)OCCCCCC(C)(C)N

InChI

InChI=1S/C29H36FNO2/c1-4-23-19-26(24-13-15-25(30)16-14-24)28(33-21-22-11-7-5-8-12-22)20-27(23)32-18-10-6-9-17-29(2,3)31/h5,7-8,11-16,19-20H,4,6,9-10,17-18,21,31H2,1-3H3