(E)-but-2-enedioic acid; 9-[3-(methylamino)butyl]fluorene-9-carboxamide

Systemtic Name: (E)-but-2-enedioic acid; 9-[3-(methylamino)butyl]fluorene-9-carboxamide Openeye Name: fumaric acid; 9-[3-(methylamino)butyl]fluorene-9-carboxamide CAS Name: (E)-2-butenedioic acid; 9-[3-(methylamino)butyl]-9-fluorenecarboxamide IUPAC Name: (E)-but-2-enedioic acid; 9-[3-(methylamino)butyl]fluorene-9-carboxamide Traditional Name: fumaric acid; 9-[3-(methylamino)butyl]fluorene-9-carboxamide Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1(C2=CC=CC=C2C3=CC=CC=C31)C(=O)N)NC.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(CCC1(C2=CC=CC=C2C3=CC=CC=C31)C(=O)N)NC.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C19H22N2O.C4H4O4/c1-13(21-2)11-12-19(18(20)22)16-9-5-3-7-14(16)15-8-4-6-10-17(15)19;5-3(6)1-2-4(7)8/h3-10,13,21H,11-12H2,1-2H3,(H2,20,22);1-2H,(H,5,6)(H,7,8)/b;2-1+