1-[4-butyl-2-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenoxy]-3-(propan-2-ylamino)propan-2-ol

Systemtic Name: 1-[4-butyl-2-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenoxy]-3-(propan-2-ylamino)propan-2-ol Openeye Name: 1-[4-butyl-2-[2-hydroxy-3-(isopropylamino)propoxy]phenoxy]-3-(isopropylamino)propan-2-ol CAS Name: 1-[4-butyl-2-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenoxy]-3-(propan-2-ylamino)-2-propanol IUPAC Name: 1-[4-butyl-2-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenoxy]-3-(propan-2-ylamino)propan-2-ol Traditional Name: 1-[4-butyl-2-[2-hydroxy-3-(isopropylamino)propoxy]phenoxy]-3-(isopropylamino)propan-2-ol Formula: C22H40N2O4 MolecularWeight: 396.564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)OCC(CNC(C)C)O)OCC(CNC(C)C)O

Isomeric SMILES

CCCCC1=CC(=C(C=C1)OCC(CNC(C)C)O)OCC(CNC(C)C)O

InChI

InChI=1S/C22H40N2O4/c1-6-7-8-18-9-10-21(27-14-19(25)12-23-16(2)3)22(11-18)28-15-20(26)13-24-17(4)5/h9-11,16-17,19-20,23-26H,6-8,12-15H2,1-5H3