2-tert-butyl-2-(phenylmethoxycarbonylamino)pentanedioic acid; dicyclohexylazanium

Systemtic Name: 2-tert-butyl-2-(phenylmethoxycarbonylamino)pentanedioic acid; dicyclohexylazanium Openeye Name: 2-(benzyloxycarbonylamino)-2-tert-butyl-pentanedioic acid; dicyclohexylammonium CAS Name: 2-tert-butyl-2-(phenylmethoxycarbonylamino)pentanedioic acid; dicyclohexylammonium IUPAC Name: 2-tert-butyl-2-(phenylmethoxycarbonylamino)pentanedioic acid; dicyclohexylazanium Traditional Name: 2-(benzyloxycarbonylamino)-2-tert-butyl-glutaric acid; dicyclohexylammonium Formula: C29H47N2O6+ MolecularWeight: 519.69328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CCC(=O)O)(C(=O)O)NC(=O)OCC1=CC=CC=C1.C1CCC(CC1)[NH2+]C2CCCCC2

Isomeric SMILES

CC(C)(C)C(CCC(=O)O)(C(=O)O)NC(=O)OCC1=CC=CC=C1.C1CCC(CC1)[NH2+]C2CCCCC2

InChI

InChI=1S/C17H23NO6.C12H23N/c1-16(2,3)17(14(21)22,10-9-13(19)20)18-15(23)24-11-12-7-5-4-6-8-12;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h4-8H,9-11H2,1-3H3,(H,18,23)(H,19,20)(H,21,22);11-13H,1-10H2/p+1