2-[4-(4-ethenylphenyl)sulfonyl-2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: 2-[4-(4-ethenylphenyl)sulfonyl-2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: 2-[1-(tert-butoxycarbonylamino)-2-methyl-6-oxo-4-(4-vinylphenyl)sulfonyl-piperazin-2-yl]acetate CAS Name: 2-[4-(4-ethenylphenyl)sulfonyl-2-methyl-1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxo-2-piperazinyl]acetate IUPAC Name: 2-[4-(4-ethenylphenyl)sulfonyl-2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(tert-butoxycarbonylamino)-6-keto-2-methyl-4-(4-vinylphenyl)sulfonyl-piperazin-2-yl]acetate Formula: C20H26N3O7S- MolecularWeight: 452.50134

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CC(=O)N1NC(=O)OC(C)(C)C)S(=O)(=O)C2=CC=C(C=C2)C=C)CC(=O)[O-]

Isomeric SMILES

CC1(CN(CC(=O)N1NC(=O)OC(C)(C)C)S(=O)(=O)C2=CC=C(C=C2)C=C)CC(=O)[O-]

InChI

InChI=1S/C20H27N3O7S/c1-6-14-7-9-15(10-8-14)31(28,29)22-12-16(24)23(20(5,13-22)11-17(25)26)21-18(27)30-19(2,3)4/h6-10H,1,11-13H2,2-5H3,(H,21,27)(H,25,26)/p-1