(E)-but-2-enedioic acid; 1-methyl-N-[2-(2-propan-2-ylphenoxy)phenyl]pyrrolidin-3-imine

Systemtic Name: (E)-but-2-enedioic acid; 1-methyl-N-[2-(2-propan-2-ylphenoxy)phenyl]pyrrolidin-3-imine Openeye Name: fumaric acid; N-[2-(2-isopropylphenoxy)phenyl]-1-methyl-pyrrolidin-3-imine CAS Name: (E)-2-butenedioic acid; 1-methyl-N-[2-(2-propan-2-ylphenoxy)phenyl]-3-pyrrolidinimine IUPAC Name: (E)-but-2-enedioic acid; 1-methyl-N-[2-(2-propan-2-ylphenoxy)phenyl]pyrrolidin-3-imine Traditional Name: fumaric acid; [2-(2-isopropylphenoxy)phenyl]-(1-methylpyrrolidin-3-ylidene)amine Formula: C24H28N2O5 MolecularWeight: 424.48952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OC2=CC=CC=C2N=C3CCN(C3)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(C)C1=CC=CC=C1OC2=CC=CC=C2N=C3CCN(C3)C.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C20H24N2O.C4H4O4/c1-15(2)17-8-4-6-10-19(17)23-20-11-7-5-9-18(20)21-16-12-13-22(3)14-16;5-3(6)1-2-4(7)8/h4-11,15H,12-14H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+