[4-[3-(2,5-dimethylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[3-(2,5-dimethylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-phenyl-methanone Openeye Name: [4-[3-(2,5-dimethylphenoxy)-2-hydroxy-propyl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[3-(2,5-dimethylphenoxy)-2-hydroxypropyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[3-(2,5-dimethylphenoxy)-2-hydroxypropyl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[3-(2,5-dimethylphenoxy)-2-hydroxy-propyl]piperazino]-phenyl-methanone Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(CN2CCN(CC2)C(=O)C3=CC=CC=C3)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC(CN2CCN(CC2)C(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C22H28N2O3/c1-17-8-9-18(2)21(14-17)27-16-20(25)15-23-10-12-24(13-11-23)22(26)19-6-4-3-5-7-19/h3-9,14,20,25H,10-13,15-16H2,1-2H3