(3R)-3-(2-chlorophenyl)-3-(3-hydroxyphenyl)-1-(4-propan-2-ylpiperazin-4-ium-1-yl)propan-1-one

Systemtic Name: (3R)-3-(2-chlorophenyl)-3-(3-hydroxyphenyl)-1-(4-propan-2-ylpiperazin-4-ium-1-yl)propan-1-one Openeye Name: (3R)-3-(2-chlorophenyl)-3-(3-hydroxyphenyl)-1-(4-isopropylpiperazin-4-ium-1-yl)propan-1-one CAS Name: (3R)-3-(2-chlorophenyl)-3-(3-hydroxyphenyl)-1-(4-propan-2-yl-1-piperazin-4-iumyl)-1-propanone IUPAC Name: (3R)-3-(2-chlorophenyl)-3-(3-hydroxyphenyl)-1-(4-propan-2-ylpiperazin-4-ium-1-yl)propan-1-one Traditional Name: (3R)-3-(2-chlorophenyl)-3-(3-hydroxyphenyl)-1-(4-isopropylpiperazin-4-ium-1-yl)propan-1-one Formula: C22H28ClN2O2+ MolecularWeight: 387.92292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCN(CC1)C(=O)CC(C2=CC(=CC=C2)O)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)[NH+]1CCN(CC1)C(=O)C[C@H](C2=CC(=CC=C2)O)C3=CC=CC=C3Cl

InChI

InChI=1S/C22H27ClN2O2/c1-16(2)24-10-12-25(13-11-24)22(27)15-20(17-6-5-7-18(26)14-17)19-8-3-4-9-21(19)23/h3-9,14,16,20,26H,10-13,15H2,1-2H3/p+1/t20-/m1/s1