4-[6-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]pyridin-1-ium-3-yl]sulfonylmorpholine

Systemtic Name: 4-[6-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]pyridin-1-ium-3-yl]sulfonylmorpholine Openeye Name: 4-[6-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]pyridin-1-ium-3-yl]sulfonylmorpholine CAS Name: 4-[[6-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]-3-pyridin-1-iumyl]sulfonyl]morpholine IUPAC Name: 4-[6-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]pyridin-1-ium-3-yl]sulfonylmorpholine Traditional Name: 4-[6-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]pyridin-1-ium-3-yl]sulfonylmorpholine Formula: C22H30N4O3S+2 MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC=CC2=CC=CC=C2)C3=[NH+]C=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CN(CC[NH+]1C/C=C/C2=CC=CC=C2)C3=[NH+]C=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H28N4O3S/c27-30(28,26-15-17-29-18-16-26)21-8-9-22(23-19-21)25-13-11-24(12-14-25)10-4-7-20-5-2-1-3-6-20/h1-9,19H,10-18H2/p+2/b7-4+