(E)-but-2-enedioic acid; 7-cyclononyl-3-phenyl-3,7-diazaspiro[3.5]nonane

Systemtic Name: (E)-but-2-enedioic acid; 7-cyclononyl-3-phenyl-3,7-diazaspiro[3.5]nonane Openeye Name: 7-cyclononyl-3-phenyl-3,7-diazaspiro[3.5]nonane; fumaric acid CAS Name: (E)-2-butenedioic acid; 7-cyclononyl-3-phenyl-3,7-diazaspiro[3.5]nonane IUPAC Name: (E)-but-2-enedioic acid; 7-cyclononyl-3-phenyl-3,7-diazaspiro[3.5]nonane Traditional Name: 7-cyclononyl-3-phenyl-3,7-diazaspiro[3.5]nonane; fumaric acid Formula: C26H38N2O4 MolecularWeight: 442.59092

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCC(CCC1)N2CCC3(CC2)CCN3C4=CC=CC=C4.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CCCCC(CCC1)N2CCC3(CC2)CCN3C4=CC=CC=C4.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C22H34N2.C4H4O4/c1-2-4-7-11-20(10-6-3-1)23-17-14-22(15-18-23)16-19-24(22)21-12-8-5-9-13-21;5-3(6)1-2-4(7)8/h5,8-9,12-13,20H,1-4,6-7,10-11,14-19H2;1-2H,(H,5,6)(H,7,8)/b;2-1+