1-(azepan-1-yl)-3-[2-(butylaminomethyl)-4-chloranyl-phenoxy]propan-2-ol

Systemtic Name: 1-(azepan-1-yl)-3-[2-(butylaminomethyl)-4-chloranyl-phenoxy]propan-2-ol Openeye Name: 1-(azepan-1-yl)-3-[2-(butylaminomethyl)-4-chloro-phenoxy]propan-2-ol CAS Name: 1-(1-azepanyl)-3-[2-(butylaminomethyl)-4-chlorophenoxy]-2-propanol IUPAC Name: 1-(azepan-1-yl)-3-[2-(butylaminomethyl)-4-chlorophenoxy]propan-2-ol Traditional Name: 1-(azepan-1-yl)-3-[2-(butylaminomethyl)-4-chloro-phenoxy]propan-2-ol Formula: C20H33ClN2O2 MolecularWeight: 368.94122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1=C(C=CC(=C1)Cl)OCC(CN2CCCCCC2)O

Isomeric SMILES

CCCCNCC1=C(C=CC(=C1)Cl)OCC(CN2CCCCCC2)O

InChI

InChI=1S/C20H33ClN2O2/c1-2-3-10-22-14-17-13-18(21)8-9-20(17)25-16-19(24)15-23-11-6-4-5-7-12-23/h8-9,13,19,22,24H,2-7,10-12,14-16H2,1H3