[4-[3-[4-(2-chlorophenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]-phenyl-methanone

Systemtic Name: [4-[3-[4-(2-chlorophenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]-phenyl-methanone Openeye Name: [4-[3-[4-(2-chlorophenyl)piperazin-1-yl]-2-hydroxy-propoxy]phenyl]-phenyl-methanone CAS Name: [4-[3-[4-(2-chlorophenyl)-1-piperazinyl]-2-hydroxypropoxy]phenyl]-phenylmethanone IUPAC Name: [4-[3-[4-(2-chlorophenyl)piperazin-1-yl]-2-hydroxypropoxy]phenyl]-phenylmethanone Traditional Name: [4-[3-[4-(2-chlorophenyl)piperazino]-2-hydroxy-propoxy]phenyl]-phenyl-methanone Formula: C26H27ClN2O3 MolecularWeight: 450.95718

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)O)C4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)O)C4=CC=CC=C4Cl

InChI

InChI=1S/C26H27ClN2O3/c27-24-8-4-5-9-25(24)29-16-14-28(15-17-29)18-22(30)19-32-23-12-10-21(11-13-23)26(31)20-6-2-1-3-7-20/h1-13,22,30H,14-19H2