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

Systemtic Name: (2R)-N-(2,4-dichlorophenyl)-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-(2,4-dichlorophenyl)-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-(2,4-dichlorophenyl)-2-[4-(2-hydroxyphenyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-(2,4-dichlorophenyl)-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-(2,4-dichlorophenyl)-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]propionamide Formula: C19H22Cl2N3O2+ MolecularWeight: 395.30288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Cl)Cl)[NH+]2CCN(CC2)C3=CC=CC=C3O

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=C(C=C1)Cl)Cl)[NH+]2CCN(CC2)C3=CC=CC=C3O

InChI

InChI=1S/C19H21Cl2N3O2/c1-13(19(26)22-16-7-6-14(20)12-15(16)21)23-8-10-24(11-9-23)17-4-2-3-5-18(17)25/h2-7,12-13,25H,8-11H2,1H3,(H,22,26)/p+1/t13-/m1/s1