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

Systemtic Name: (2R)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-(2-phenylphenyl)propanamide Openeye Name: (2R)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-(2-phenylphenyl)propanamide CAS Name: (2R)-2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]-N-(2-phenylphenyl)propanamide IUPAC Name: (2R)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-(2-phenylphenyl)propanamide Traditional Name: (2R)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-(2-phenylphenyl)propionamide Formula: C25H28N3O2+ MolecularWeight: 402.50872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+]3CCN(CC3)C4=CC=C(C=C4)O

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+]3CCN(CC3)C4=CC=C(C=C4)O

InChI

InChI=1S/C25H27N3O2/c1-19(27-15-17-28(18-16-27)21-11-13-22(29)14-12-21)25(30)26-24-10-6-5-9-23(24)20-7-3-2-4-8-20/h2-14,19,29H,15-18H2,1H3,(H,26,30)/p+1/t19-/m1/s1