4-[[2-(2-isocyanopyrrolidin-1-yl)-2-oxidanylidene-ethyl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[2-(2-isocyanopyrrolidin-1-yl)-2-oxidanylidene-ethyl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]cyclohexane-1-carboxylic acid Openeye Name: 4-[tert-butoxycarbonyl-[2-(2-isocyanopyrrolidin-1-yl)-2-oxo-ethyl]amino]cyclohexanecarboxylic acid CAS Name: 4-[[2-(2-isocyano-1-pyrrolidinyl)-2-oxoethyl]-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[2-(2-isocyanopyrrolidin-1-yl)-2-oxoethyl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]cyclohexane-1-carboxylic acid Traditional Name: 4-[tert-butoxycarbonyl-[2-(2-isocyanopyrrolidino)-2-keto-ethyl]amino]cyclohexanecarboxylic acid Formula: C19H29N3O5 MolecularWeight: 379.45066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC(=O)N1CCCC1[N+]#[C-])C2CCC(CC2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N(CC(=O)N1CCCC1[N+]#[C-])C2CCC(CC2)C(=O)O

InChI

InChI=1S/C19H29N3O5/c1-19(2,3)27-18(26)22(14-9-7-13(8-10-14)17(24)25)12-16(23)21-11-5-6-15(21)20-4/h13-15H,5-12H2,1-3H3,(H,24,25)