decanedioic acid; 2,2,4-trimethyl-3-azabicyclo[2.2.2]octan-6-ol

Systemtic Name: decanedioic acid; 2,2,4-trimethyl-3-azabicyclo[2.2.2]octan-6-ol Openeye Name: decanedioic acid; 2,2,4-trimethyl-3-azabicyclo[2.2.2]octan-6-ol CAS Name: decanedioic acid; 2,2,4-trimethyl-3-azabicyclo[2.2.2]octan-6-ol IUPAC Name: decanedioic acid; 2,2,4-trimethyl-3-azabicyclo[2.2.2]octan-6-ol Traditional Name: sebacic acid; 2,2,4-trimethyl-3-azabicyclo[2.2.2]octan-6-ol Formula: C30H56N2O6 MolecularWeight: 540.77544

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC(N1)(CC2O)C)C.CC1(C2CCC(N1)(CC2O)C)C.C(CCCCC(=O)O)CCCC(=O)O

Isomeric SMILES

CC1(C2CCC(N1)(CC2O)C)C.CC1(C2CCC(N1)(CC2O)C)C.C(CCCCC(=O)O)CCCC(=O)O

InChI

InChI=1S/2C10H19NO.C10H18O4/c2*1-9(2)7-4-5-10(3,11-9)6-8(7)12;11-9(12)7-5-3-1-2-4-6-8-10(13)14/h2*7-8,11-12H,4-6H2,1-3H3;1-8H2,(H,11,12)(H,13,14)