(E)-but-2-enedioic acid; (E)-1-[4-(2-dimethylaminoethylamino)phenyl]-3-phenyl-prop-2-en-1-one

Systemtic Name: (E)-but-2-enedioic acid; (E)-1-[4-(2-dimethylaminoethylamino)phenyl]-3-phenyl-prop-2-en-1-one Openeye Name: (E)-1-[4-(2-dimethylaminoethylamino)phenyl]-3-phenyl-prop-2-en-1-one; fumaric acid CAS Name: (E)-2-butenedioic acid; (E)-1-[4-(2-dimethylaminoethylamino)phenyl]-3-phenyl-2-propen-1-one IUPAC Name: (E)-but-2-enedioic acid; (E)-1-[4-(2-dimethylaminoethylamino)phenyl]-3-phenylprop-2-en-1-one Traditional Name: (E)-1-[4-(2-dimethylaminoethylamino)phenyl]-3-phenyl-prop-2-en-1-one; fumaric acid Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC1=CC=C(C=C1)C(=O)C=CC2=CC=CC=C2.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN(C)CCNC1=CC=C(C=C1)C(=O)/C=C/C2=CC=CC=C2.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C19H22N2O.C4H4O4/c1-21(2)15-14-20-18-11-9-17(10-12-18)19(22)13-8-16-6-4-3-5-7-16;5-3(6)1-2-4(7)8/h3-13,20H,14-15H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b13-8+;2-1+