2-[4-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-[4-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Openeye Name: 2-[4-[3-(4-chlorophenoxy)-2-hydroxy-propyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one CAS Name: 2-[4-[3-(4-chlorophenoxy)-2-hydroxypropyl]-1-piperazinyl]-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-[4-[3-(4-chlorophenoxy)-2-hydroxypropyl]piperazin-1-yl]cyclohepta-2,4,6-trien-1-one Traditional Name: 2-[4-[3-(4-chlorophenoxy)-2-hydroxy-propyl]piperazino]cyclohepta-2,4,6-trien-1-one Formula: C20H23ClN2O3 MolecularWeight: 374.86122

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=C(C=C2)Cl)O)C3=CC=CC=CC3=O

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=C(C=C2)Cl)O)C3=CC=CC=CC3=O

InChI

InChI=1S/C20H23ClN2O3/c21-16-6-8-18(9-7-16)26-15-17(24)14-22-10-12-23(13-11-22)19-4-2-1-3-5-20(19)25/h1-9,17,24H,10-15H2