(E)-but-2-enedioic acid; N-[4-(2-diethylaminoethyloxy)phenyl]-2-phenyl-3,4-dihydropyrazol-5-amine

Systemtic Name: (E)-but-2-enedioic acid; N-[4-(2-diethylaminoethyloxy)phenyl]-2-phenyl-3,4-dihydropyrazol-5-amine Openeye Name: N-[4-(2-diethylaminoethyloxy)phenyl]-2-phenyl-3,4-dihydropyrazol-5-amine; fumaric acid CAS Name: (E)-2-butenedioic acid; N-[4-(2-diethylaminoethyloxy)phenyl]-2-phenyl-3,4-dihydropyrazol-5-amine IUPAC Name: (E)-but-2-enedioic acid; N-[4-(2-diethylaminoethyloxy)phenyl]-2-phenyl-3,4-dihydropyrazol-5-amine Traditional Name: diethyl-[2-[4-[(1-phenyl-2-pyrazolin-3-yl)amino]phenoxy]ethyl]amine; fumaric acid Formula: C25H32N4O5 MolecularWeight: 468.54538

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC=C(C=C1)NC2=NN(CC2)C3=CC=CC=C3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCN(CC)CCOC1=CC=C(C=C1)NC2=NN(CC2)C3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C21H28N4O.C4H4O4/c1-3-24(4-2)16-17-26-20-12-10-18(11-13-20)22-21-14-15-25(23-21)19-8-6-5-7-9-19;5-3(6)1-2-4(7)8/h5-13H,3-4,14-17H2,1-2H3,(H,22,23);1-2H,(H,5,6)(H,7,8)/b;2-1+