1-[4-[2-oxidanyl-3-[(phenylmethyl)-propan-2-yl-amino]propoxy]phenyl]ethanone

Systemtic Name: 1-[4-[2-oxidanyl-3-[(phenylmethyl)-propan-2-yl-amino]propoxy]phenyl]ethanone Openeye Name: 1-[4-[3-[benzyl(isopropyl)amino]-2-hydroxy-propoxy]phenyl]ethanone CAS Name: 1-[4-[2-hydroxy-3-[(phenylmethyl)-propan-2-ylamino]propoxy]phenyl]ethanone IUPAC Name: 1-[4-[3-[benzyl(propan-2-yl)amino]-2-hydroxypropoxy]phenyl]ethanone Traditional Name: 1-[4-[3-[benzyl(isopropyl)amino]-2-hydroxy-propoxy]phenyl]ethanone Formula: C21H27NO3 MolecularWeight: 341.44398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)CC(COC2=CC=C(C=C2)C(=O)C)O

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)CC(COC2=CC=C(C=C2)C(=O)C)O

InChI

InChI=1S/C21H27NO3/c1-16(2)22(13-18-7-5-4-6-8-18)14-20(24)15-25-21-11-9-19(10-12-21)17(3)23/h4-12,16,20,24H,13-15H2,1-3H3