[4-[3-(2-chloranyl-5-methyl-phenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[3-(2-chloranyl-5-methyl-phenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-phenyl-methanone Openeye Name: [4-[3-(2-chloro-5-methyl-phenoxy)-2-hydroxy-propyl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[3-(2-chloro-5-methylphenoxy)-2-hydroxypropyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[3-(2-chloro-5-methylphenoxy)-2-hydroxypropyl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[3-(2-chloro-5-methyl-phenoxy)-2-hydroxy-propyl]piperazino]-phenyl-methanone Formula: C21H25ClN2O3 MolecularWeight: 388.8878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN2O3/c1-16-7-8-19(22)20(13-16)27-15-18(25)14-23-9-11-24(12-10-23)21(26)17-5-3-2-4-6-17/h2-8,13,18,25H,9-12,14-15H2,1H3