1-(azocan-1-yl)-3-[2-methoxy-5-[(3-pyrazol-1-ylpropylamino)methyl]phenoxy]propan-2-ol

Systemtic Name: 1-(azocan-1-yl)-3-[2-methoxy-5-[(3-pyrazol-1-ylpropylamino)methyl]phenoxy]propan-2-ol Openeye Name: 1-(azocan-1-yl)-3-[2-methoxy-5-[(3-pyrazol-1-ylpropylamino)methyl]phenoxy]propan-2-ol CAS Name: 1-(1-azocanyl)-3-[2-methoxy-5-[[3-(1-pyrazolyl)propylamino]methyl]phenoxy]-2-propanol IUPAC Name: 1-(azocan-1-yl)-3-[2-methoxy-5-[(3-pyrazol-1-ylpropylamino)methyl]phenoxy]propan-2-ol Traditional Name: 1-(azocan-1-yl)-3-[2-methoxy-5-[(3-pyrazol-1-ylpropylamino)methyl]phenoxy]propan-2-ol Formula: C24H38N4O3 MolecularWeight: 430.58352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNCCCN2C=CC=N2)OCC(CN3CCCCCCC3)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNCCCN2C=CC=N2)OCC(CN3CCCCCCC3)O

InChI

InChI=1S/C24H38N4O3/c1-30-23-10-9-21(18-25-11-7-15-28-16-8-12-26-28)17-24(23)31-20-22(29)19-27-13-5-3-2-4-6-14-27/h8-10,12,16-17,22,25,29H,2-7,11,13-15,18-20H2,1H3