(2S)-5-methoxy-2-[[(5S)-6-methoxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexyl]azaniumyl]-5-oxidanylidene-pentanoate

Systemtic Name: (2S)-5-methoxy-2-[[(5S)-6-methoxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexyl]azaniumyl]-5-oxidanylidene-pentanoate Openeye Name: (2S)-2-[[(5S)-5-(tert-butoxycarbonylamino)-6-methoxy-6-oxo-hexyl]ammonio]-5-methoxy-5-oxo-pentanoate CAS Name: (2S)-5-methoxy-2-[[(5S)-6-methoxy-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxohexyl]ammonio]-5-oxopentanoate IUPAC Name: (2S)-5-methoxy-2-[[(5S)-6-methoxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxohexyl]azaniumyl]-5-oxopentanoate Traditional Name: (2S)-2-[[(5S)-5-(tert-butoxycarbonylamino)-6-keto-6-methoxy-hexyl]ammonio]-5-keto-5-methoxy-valerate Formula: C18H32N2O8 MolecularWeight: 404.45528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCC[NH2+]C(CCC(=O)OC)C(=O)[O-])C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCCC[NH2+][C@@H](CCC(=O)OC)C(=O)[O-])C(=O)OC

InChI

InChI=1S/C18H32N2O8/c1-18(2,3)28-17(25)20-13(16(24)27-5)8-6-7-11-19-12(15(22)23)9-10-14(21)26-4/h12-13,19H,6-11H2,1-5H3,(H,20,25)(H,22,23)/t12-,13-/m0/s1