N-methyl-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-ium-1-yl]-N-[(1R)-1-phenylethyl]ethanamide

Systemtic Name: N-methyl-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-ium-1-yl]-N-[(1R)-1-phenylethyl]ethanamide Openeye Name: N-methyl-N-[(1R)-1-phenylethyl]-2-[4-[(E)-styryl]sulfonylpiperazin-1-ium-1-yl]acetamide CAS Name: N-methyl-2-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazin-1-iumyl]-N-[(1R)-1-phenylethyl]acetamide IUPAC Name: N-methyl-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-ium-1-yl]-N-[(1R)-1-phenylethyl]acetamide Traditional Name: N-methyl-N-[(1R)-1-phenylethyl]-2-[4-[(E)-styryl]sulfonylpiperazin-1-ium-1-yl]acetamide Formula: C23H30N3O3S+ MolecularWeight: 428.5676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(C)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N(C)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C23H29N3O3S/c1-20(22-11-7-4-8-12-22)24(2)23(27)19-25-14-16-26(17-15-25)30(28,29)18-13-21-9-5-3-6-10-21/h3-13,18,20H,14-17,19H2,1-2H3/p+1/b18-13+/t20-/m1/s1