6-[2-(6-azanyl-2-methyl-heptan-2-yl)-3-phenoxy-phenyl]-6-methyl-heptan-2-amine

Systemtic Name: 6-[2-(6-azanyl-2-methyl-heptan-2-yl)-3-phenoxy-phenyl]-6-methyl-heptan-2-amine Openeye Name: 6-[2-(5-amino-1,1-dimethyl-hexyl)-3-phenoxy-phenyl]-6-methyl-heptan-2-amine CAS Name: 6-[2-(6-amino-2-methylheptan-2-yl)-3-phenoxyphenyl]-6-methyl-2-heptanamine IUPAC Name: 6-[2-(6-amino-2-methylheptan-2-yl)-3-phenoxyphenyl]-6-methylheptan-2-amine Traditional Name: [5-[2-(5-amino-1,1-dimethyl-hexyl)-3-phenoxy-phenyl]-1,5-dimethyl-hexyl]amine Formula: C28H44N2O MolecularWeight: 424.66176

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)(C)C1=C(C(=CC=C1)OC2=CC=CC=C2)C(C)(C)CCCC(C)N)N

Isomeric SMILES

CC(CCCC(C)(C)C1=C(C(=CC=C1)OC2=CC=CC=C2)C(C)(C)CCCC(C)N)N

InChI

InChI=1S/C28H44N2O/c1-21(29)13-11-19-27(3,4)24-17-10-18-25(31-23-15-8-7-9-16-23)26(24)28(5,6)20-12-14-22(2)30/h7-10,15-18,21-22H,11-14,19-20,29-30H2,1-6H3