[4-tert-butyl-1-(phenethylamino)cyclohexyl]phosphonic acid

Systemtic Name: [4-tert-butyl-1-(phenethylamino)cyclohexyl]phosphonic acid Openeye Name: [4-tert-butyl-1-(phenethylamino)cyclohexyl]phosphonic acid CAS Name: [4-tert-butyl-1-(phenethylamino)cyclohexyl]phosphonic acid IUPAC Name: [4-tert-butyl-1-(phenethylamino)cyclohexyl]phosphonic acid Traditional Name: [4-tert-butyl-1-(phenethylamino)cyclohexyl]phosphonic acid Formula: C18H30NO3P MolecularWeight: 339.409461

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)(NCCC2=CC=CC=C2)P(=O)(O)O

Isomeric SMILES

CC(C)(C)C1CCC(CC1)(NCCC2=CC=CC=C2)P(=O)(O)O

InChI

InChI=1S/C18H30NO3P/c1-17(2,3)16-9-12-18(13-10-16,23(20,21)22)19-14-11-15-7-5-4-6-8-15/h4-8,16,19H,9-14H2,1-3H3,(H2,20,21,22)