(E)-but-2-enedioic acid; 1,3,6-trimethyl-4-phenyl-3,6-dihydro-2H-pyridine

Systemtic Name: (E)-but-2-enedioic acid; 1,3,6-trimethyl-4-phenyl-3,6-dihydro-2H-pyridine Openeye Name: fumaric acid; 1,3,6-trimethyl-4-phenyl-3,6-dihydro-2H-pyridine CAS Name: (E)-2-butenedioic acid; 1,3,6-trimethyl-4-phenyl-3,6-dihydro-2H-pyridine IUPAC Name: (E)-but-2-enedioic acid; 1,3,6-trimethyl-4-phenyl-3,6-dihydro-2H-pyridine Traditional Name: fumaric acid; 1,3,6-trimethyl-4-phenyl-3,6-dihydro-2H-pyridine Formula: C18H23NO4 MolecularWeight: 317.37952

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(C=C1C2=CC=CC=C2)C)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1CN(C(C=C1C2=CC=CC=C2)C)C.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C14H19N.C4H4O4/c1-11-10-15(3)12(2)9-14(11)13-7-5-4-6-8-13;5-3(6)1-2-4(7)8/h4-9,11-12H,10H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+