2-[4-[3-(4-bromanylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-N-cyclopropyl-propanamide

Systemtic Name: 2-[4-[3-(4-bromanylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-N-cyclopropyl-propanamide Openeye Name: 2-[4-[3-(4-bromophenoxy)-2-hydroxy-propyl]piperazin-1-yl]-N-cyclopropyl-propanamide CAS Name: 2-[4-[3-(4-bromophenoxy)-2-hydroxypropyl]-1-piperazinyl]-N-cyclopropylpropanamide IUPAC Name: 2-[4-[3-(4-bromophenoxy)-2-hydroxypropyl]piperazin-1-yl]-N-cyclopropylpropanamide Traditional Name: 2-[4-[3-(4-bromophenoxy)-2-hydroxy-propyl]piperazino]-N-cyclopropyl-propionamide Formula: C19H28BrN3O3 MolecularWeight: 426.34792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)N2CCN(CC2)CC(COC3=CC=C(C=C3)Br)O

Isomeric SMILES

CC(C(=O)NC1CC1)N2CCN(CC2)CC(COC3=CC=C(C=C3)Br)O

InChI

InChI=1S/C19H28BrN3O3/c1-14(19(25)21-16-4-5-16)23-10-8-22(9-11-23)12-17(24)13-26-18-6-2-15(20)3-7-18/h2-3,6-7,14,16-17,24H,4-5,8-13H2,1H3,(H,21,25)