1-(4-chloranylphenoxy)-3-[(2,5-dimethylphenyl)methyl-propyl-amino]propan-2-ol

Systemtic Name: 1-(4-chloranylphenoxy)-3-[(2,5-dimethylphenyl)methyl-propyl-amino]propan-2-ol Openeye Name: 1-(4-chlorophenoxy)-3-[(2,5-dimethylphenyl)methyl-propyl-amino]propan-2-ol CAS Name: 1-(4-chlorophenoxy)-3-[(2,5-dimethylphenyl)methyl-propylamino]-2-propanol IUPAC Name: 1-(4-chlorophenoxy)-3-[(2,5-dimethylphenyl)methyl-propylamino]propan-2-ol Traditional Name: 1-(4-chlorophenoxy)-3-[(2,5-dimethylbenzyl)-propyl-amino]propan-2-ol Formula: C21H28ClNO2 MolecularWeight: 361.90552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=C(C=CC(=C1)C)C)CC(COC2=CC=C(C=C2)Cl)O

Isomeric SMILES

CCCN(CC1=C(C=CC(=C1)C)C)CC(COC2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C21H28ClNO2/c1-4-11-23(13-18-12-16(2)5-6-17(18)3)14-20(24)15-25-21-9-7-19(22)8-10-21/h5-10,12,20,24H,4,11,13-15H2,1-3H3