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

Systemtic Name: (2R)-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide Openeye Name: (2R)-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-(4-morpholinophenyl)propanamide CAS Name: (2R)-2-[4-(2-hydroxyphenyl)-1-piperazin-1-iumyl]-N-[4-(4-morpholinyl)phenyl]propanamide IUPAC Name: (2R)-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide Traditional Name: (2R)-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-(4-morpholinophenyl)propionamide Formula: C23H31N4O3+ MolecularWeight: 411.51724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)[NH+]3CCN(CC3)C4=CC=CC=C4O

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)N2CCOCC2)[NH+]3CCN(CC3)C4=CC=CC=C4O

InChI

InChI=1S/C23H30N4O3/c1-18(25-10-12-27(13-11-25)21-4-2-3-5-22(21)28)23(29)24-19-6-8-20(9-7-19)26-14-16-30-17-15-26/h2-9,18,28H,10-17H2,1H3,(H,24,29)/p+1/t18-/m1/s1