2-azanyl-2-[6-[ethenylsulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]hexanoyl]pentanedioic acid

Systemtic Name: 2-azanyl-2-[6-[ethenylsulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]hexanoyl]pentanedioic acid Openeye Name: 2-amino-2-[6-[tert-butoxycarbonyl(vinylsulfonyl)amino]hexanoyl]pentanedioic acid CAS Name: 2-amino-2-[6-[ethenylsulfonyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxohexyl]pentanedioic acid IUPAC Name: 2-amino-2-[6-[ethenylsulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]hexanoyl]pentanedioic acid Traditional Name: 2-amino-2-[6-[tert-butoxycarbonyl(vinylsulfonyl)amino]hexanoyl]glutaric acid Formula: C18H30N2O9S MolecularWeight: 450.5038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCCCCC(=O)C(CCC(=O)O)(C(=O)O)N)S(=O)(=O)C=C

Isomeric SMILES

CC(C)(C)OC(=O)N(CCCCCC(=O)C(CCC(=O)O)(C(=O)O)N)S(=O)(=O)C=C

InChI

InChI=1S/C18H30N2O9S/c1-5-30(27,28)20(16(26)29-17(2,3)4)12-8-6-7-9-13(21)18(19,15(24)25)11-10-14(22)23/h5H,1,6-12,19H2,2-4H3,(H,22,23)(H,24,25)