dicyclohexylazanium; (2S)-2-[[(2-methylpropan-2-yl)oxycarbonylamino]-(phenylmethyl)amino]propanoate

Systemtic Name: dicyclohexylazanium; (2S)-2-[[(2-methylpropan-2-yl)oxycarbonylamino]-(phenylmethyl)amino]propanoate Openeye Name: (2S)-2-[benzyl-(tert-butoxycarbonylamino)amino]propanoate; dicyclohexylammonium CAS Name: dicyclohexylammonium; (2S)-2-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-(phenylmethyl)amino]propanoate IUPAC Name: (2S)-2-[benzyl-[(2-methylpropan-2-yl)oxycarbonylamino]amino]propanoate; dicyclohexylazanium Traditional Name: (2S)-2-[benzyl-(tert-butoxycarbonylamino)amino]propionate; dicyclohexylammonium Formula: C27H45N3O4 MolecularWeight: 475.6639

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])N(CC1=CC=CC=C1)NC(=O)OC(C)(C)C.C1CCC(CC1)[NH2+]C2CCCCC2

Isomeric SMILES

C[C@@H](C(=O)[O-])N(CC1=CC=CC=C1)NC(=O)OC(C)(C)C.C1CCC(CC1)[NH2+]C2CCCCC2

InChI

InChI=1S/C15H22N2O4.C12H23N/c1-11(13(18)19)17(10-12-8-6-5-7-9-12)16-14(20)21-15(2,3)4;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h5-9,11H,10H2,1-4H3,(H,16,20)(H,18,19);11-13H,1-10H2/t11-;/m0./s1