ethyl-[2-oxidanylidene-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethyl]-(phenylmethyl)azanium

Systemtic Name: ethyl-[2-oxidanylidene-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethyl]-(phenylmethyl)azanium Openeye Name: benzyl-ethyl-[2-oxo-2-[4-[(E)-styryl]sulfonylpiperazin-1-yl]ethyl]ammonium CAS Name: ethyl-[2-oxo-2-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]ethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-ethyl-[2-oxo-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethyl]azanium Traditional Name: benzyl-ethyl-[2-keto-2-[4-[(E)-styryl]sulfonylpiperazino]ethyl]ammonium Formula: C23H30N3O3S+ MolecularWeight: 428.5676

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CC(=O)N2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CC(=O)N2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C23H29N3O3S/c1-2-24(19-22-11-7-4-8-12-22)20-23(27)25-14-16-26(17-15-25)30(28,29)18-13-21-9-5-3-6-10-21/h3-13,18H,2,14-17,19-20H2,1H3/p+1/b18-13+