(2R)-N-(2-chlorophenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-(2-chlorophenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-(2-chlorophenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-(2-chlorophenyl)-2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-(2-chlorophenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-(2-chlorophenyl)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]propionamide Formula: C19H23ClN3O2+ MolecularWeight: 360.85782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1Cl)[NH+]2CCN(CC2)C3=CC=C(C=C3)O

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1Cl)[NH+]2CCN(CC2)C3=CC=C(C=C3)O

InChI

InChI=1S/C19H22ClN3O2/c1-14(19(25)21-18-5-3-2-4-17(18)20)22-10-12-23(13-11-22)15-6-8-16(24)9-7-15/h2-9,14,24H,10-13H2,1H3,(H,21,25)/p+1/t14-/m1/s1