6-(1-azanyl-1-oxidanylidene-decan-3-yl)oxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-(1-azanyl-1-oxidanylidene-decan-3-yl)oxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-[1-(2-amino-2-oxo-ethyl)octoxy]-5-(tert-butoxycarbonylamino)-6-oxo-hexanoic acid CAS Name: 6-(1-amino-1-oxodecan-3-yl)oxy-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxohexanoic acid IUPAC Name: 6-(1-amino-1-oxodecan-3-yl)oxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxohexanoic acid Traditional Name: 6-[1-(2-amino-2-keto-ethyl)octoxy]-5-(tert-butoxycarbonylamino)-6-keto-hexanoic acid Formula: C21H38N2O7 MolecularWeight: 430.53562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CC(=O)N)OC(=O)C(CCCC(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCC(CC(=O)N)OC(=O)C(CCCC(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H38N2O7/c1-5-6-7-8-9-11-15(14-17(22)24)29-19(27)16(12-10-13-18(25)26)23-20(28)30-21(2,3)4/h15-16H,5-14H2,1-4H3,(H2,22,24)(H,23,28)(H,25,26)