6-[2-(aminomethyl)-3-(hydroxymethyl)-6-(6-pyrimidin-2-ylhexyl)phenyl]hexanal

Systemtic Name: 6-[2-(aminomethyl)-3-(hydroxymethyl)-6-(6-pyrimidin-2-ylhexyl)phenyl]hexanal Openeye Name: 6-[2-(aminomethyl)-3-(hydroxymethyl)-6-(6-pyrimidin-2-ylhexyl)phenyl]hexanal CAS Name: 6-[2-(aminomethyl)-3-(hydroxymethyl)-6-[6-(2-pyrimidinyl)hexyl]phenyl]hexanal IUPAC Name: 6-[2-(aminomethyl)-3-(hydroxymethyl)-6-(6-pyrimidin-2-ylhexyl)phenyl]hexanal Traditional Name: 6-[2-(aminomethyl)-3-methylol-6-[6-(2-pyrimidyl)hexyl]phenyl]hexanal Formula: C24H35N3O2 MolecularWeight: 397.5536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)CCCCCCC2=C(C(=C(C=C2)CO)CN)CCCCCC=O

Isomeric SMILES

C1=CN=C(N=C1)CCCCCCC2=C(C(=C(C=C2)CO)CN)CCCCCC=O

InChI

InChI=1S/C24H35N3O2/c25-18-23-21(19-29)14-13-20(22(23)11-6-3-4-8-17-28)10-5-1-2-7-12-24-26-15-9-16-27-24/h9,13-17,29H,1-8,10-12,18-19,25H2