2-cyano-1-[6-(4-phenylmethoxyphenoxy)hexyl]-1-pyridin-4-yl-guanidine

Systemtic Name: 2-cyano-1-[6-(4-phenylmethoxyphenoxy)hexyl]-1-pyridin-4-yl-guanidine Openeye Name: 1-[6-(4-benzyloxyphenoxy)hexyl]-2-cyano-1-(4-pyridyl)guanidine CAS Name: 2-cyano-1-[6-(4-phenylmethoxyphenoxy)hexyl]-1-pyridin-4-ylguanidine IUPAC Name: 2-cyano-1-[6-(4-phenylmethoxyphenoxy)hexyl]-1-pyridin-4-ylguanidine Traditional Name: 1-[6-(4-benzoxyphenoxy)hexyl]-2-cyano-1-(4-pyridyl)guanidine Formula: C26H29N5O2 MolecularWeight: 443.54076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)OCCCCCCN(C3=CC=NC=C3)C(=NC#N)N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)OCCCCCCN(C3=CC=NC=C3)C(=NC#N)N

InChI

InChI=1S/C26H29N5O2/c27-21-30-26(28)31(23-14-16-29-17-15-23)18-6-1-2-7-19-32-24-10-12-25(13-11-24)33-20-22-8-4-3-5-9-22/h3-5,8-17H,1-2,6-7,18-20H2,(H2,28,30)