dicyclohexylazanium; (2S)-5-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentanoate

Systemtic Name: dicyclohexylazanium; (2S)-5-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentanoate Openeye Name: (2S)-2-(tert-butoxycarbonylamino)-5-methoxy-5-oxo-pentanoate; dicyclohexylammonium CAS Name: dicyclohexylammonium; (2S)-5-methoxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-oxopentanoate IUPAC Name: dicyclohexylazanium; (2S)-5-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-5-keto-5-methoxy-valerate; dicyclohexylammonium Formula: C23H42N2O6 MolecularWeight: 442.58938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC(=O)OC)C(=O)[O-].C1CCC(CC1)[NH2+]C2CCCCC2

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCC(=O)OC)C(=O)[O-].C1CCC(CC1)[NH2+]C2CCCCC2

InChI

InChI=1S/C12H23N.C11H19NO6/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-11(2,3)18-10(16)12-7(9(14)15)5-6-8(13)17-4/h11-13H,1-10H2;7H,5-6H2,1-4H3,(H,12,16)(H,14,15)/t;7-/m.0/s1