(E)-5-oxidanylidene-5-[2-(4-pyrazol-1-ylphenyl)ethylamino]pent-2-enoic acid

Systemtic Name: (E)-5-oxidanylidene-5-[2-(4-pyrazol-1-ylphenyl)ethylamino]pent-2-enoic acid Openeye Name: (E)-5-oxo-5-[2-(4-pyrazol-1-ylphenyl)ethylamino]pent-2-enoic acid CAS Name: (E)-5-oxo-5-[2-[4-(1-pyrazolyl)phenyl]ethylamino]-2-pentenoic acid IUPAC Name: (E)-5-oxo-5-[2-(4-pyrazol-1-ylphenyl)ethylamino]pent-2-enoic acid Traditional Name: (E)-5-keto-5-[2-(4-pyrazol-1-ylphenyl)ethylamino]pent-2-enoic acid Formula: C16H17N3O3 MolecularWeight: 299.32448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC=C(C=C2)CCNC(=O)CC=CC(=O)O

Isomeric SMILES

C1=CN(N=C1)C2=CC=C(C=C2)CCNC(=O)C/C=C/C(=O)O

InChI

InChI=1S/C16H17N3O3/c20-15(3-1-4-16(21)22)17-11-9-13-5-7-14(8-6-13)19-12-2-10-18-19/h1-2,4-8,10,12H,3,9,11H2,(H,17,20)(H,21,22)/b4-1+