6-[1-(methylamino)-1-oxidanylidene-pentadecan-2-yl]oxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[1-(methylamino)-1-oxidanylidene-pentadecan-2-yl]oxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexanoic acid Openeye Name: 5-(tert-butoxycarbonylamino)-6-[1-(methylcarbamoyl)tetradecoxy]-6-oxo-hexanoic acid CAS Name: 6-[1-(methylamino)-1-oxopentadecan-2-yl]oxy-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxohexanoic acid IUPAC Name: 6-[1-(methylamino)-1-oxopentadecan-2-yl]oxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxohexanoic acid Traditional Name: 5-(tert-butoxycarbonylamino)-6-keto-6-[1-(methylcarbamoyl)tetradecoxy]hexanoic acid Formula: C27H50N2O7 MolecularWeight: 514.6951

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(C(=O)NC)OC(=O)C(CCCC(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCC(C(=O)NC)OC(=O)C(CCCC(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C27H50N2O7/c1-6-7-8-9-10-11-12-13-14-15-16-19-22(24(32)28-5)35-25(33)21(18-17-20-23(30)31)29-26(34)36-27(2,3)4/h21-22H,6-20H2,1-5H3,(H,28,32)(H,29,34)(H,30,31)