(E)-but-2-enedioic acid; 4-(2-diethylaminoethyloxy)-3-phenyl-1-(phenylmethyl)-2H-pyrrol-5-one

Systemtic Name: (E)-but-2-enedioic acid; 4-(2-diethylaminoethyloxy)-3-phenyl-1-(phenylmethyl)-2H-pyrrol-5-one Openeye Name: 1-benzyl-4-(2-diethylaminoethyloxy)-3-phenyl-2H-pyrrol-5-one; fumaric acid CAS Name: (E)-2-butenedioic acid; 4-(2-diethylaminoethyloxy)-3-phenyl-1-(phenylmethyl)-2H-pyrrol-5-one IUPAC Name: 1-benzyl-4-(2-diethylaminoethyloxy)-3-phenyl-2H-pyrrol-5-one; (E)-but-2-enedioic acid Traditional Name: 1-benzyl-3-(2-diethylaminoethyloxy)-4-phenyl-3-pyrrolin-2-one; fumaric acid Formula: C27H32N2O6 MolecularWeight: 480.55278

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=C(CN(C1=O)CC2=CC=CC=C2)C3=CC=CC=C3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCN(CC)CCOC1=C(CN(C1=O)CC2=CC=CC=C2)C3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C23H28N2O2.C4H4O4/c1-3-24(4-2)15-16-27-22-21(20-13-9-6-10-14-20)18-25(23(22)26)17-19-11-7-5-8-12-19;5-3(6)1-2-4(7)8/h5-14H,3-4,15-18H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+