(E)-1-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3-(4-morpholinosulfonylphenyl)prop-2-en-1-one CAS Name: (E)-1-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-3-[4-(4-morpholinylsulfonyl)phenyl]-2-propen-1-one IUPAC Name: (E)-1-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-en-1-one Traditional Name: (E)-1-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-3-(4-morpholinosulfonylphenyl)prop-2-en-1-one Formula: C19H28N3O5S+ MolecularWeight: 410.50772

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCO)C(=O)C=CC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

C1CN(CC[NH+]1CCO)C(=O)/C=C/C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H27N3O5S/c23-14-11-20-7-9-21(10-8-20)19(24)6-3-17-1-4-18(5-2-17)28(25,26)22-12-15-27-16-13-22/h1-6,23H,7-16H2/p+1/b6-3+