2-[1-azanyl-4-(4-ethenylphenyl)sulfonyl-2-methyl-6-oxidanylidene-piperazin-2-yl]ethanoic acid

Systemtic Name: 2-[1-azanyl-4-(4-ethenylphenyl)sulfonyl-2-methyl-6-oxidanylidene-piperazin-2-yl]ethanoic acid Openeye Name: 2-[1-amino-2-methyl-6-oxo-4-(4-vinylphenyl)sulfonyl-piperazin-2-yl]acetic acid CAS Name: 2-[1-amino-4-(4-ethenylphenyl)sulfonyl-2-methyl-6-oxo-2-piperazinyl]acetic acid IUPAC Name: 2-[1-amino-4-(4-ethenylphenyl)sulfonyl-2-methyl-6-oxopiperazin-2-yl]acetic acid Traditional Name: 2-[1-amino-6-keto-2-methyl-4-(4-vinylphenyl)sulfonyl-piperazin-2-yl]acetic acid Formula: C15H19N3O5S MolecularWeight: 353.39346

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CC(=O)N1N)S(=O)(=O)C2=CC=C(C=C2)C=C)CC(=O)O

Isomeric SMILES

CC1(CN(CC(=O)N1N)S(=O)(=O)C2=CC=C(C=C2)C=C)CC(=O)O

InChI

InChI=1S/C15H19N3O5S/c1-3-11-4-6-12(7-5-11)24(22,23)17-9-13(19)18(16)15(2,10-17)8-14(20)21/h3-7H,1,8-10,16H2,2H3,(H,20,21)