2-(4-tert-butylphenoxy)-N-[(E)-[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]ethanamide

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[(E)-[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[(E)-[3-(2-oxochromen-3-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[(E)-[3-(2-oxo-1-benzopyran-3-yl)-1-phenyl-4-pyrazolyl]methylideneamino]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[(E)-[3-(2-oxochromen-3-yl)-1-phenylpyrazol-4-yl]methylideneamino]acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[(E)-[3-(2-ketochromen-3-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]acetamide Formula: C31H28N4O4 MolecularWeight: 520.57842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NN=CC2=CN(N=C2C3=CC4=CC=CC=C4OC3=O)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)N/N=C/C2=CN(N=C2C3=CC4=CC=CC=C4OC3=O)C5=CC=CC=C5

InChI

InChI=1S/C31H28N4O4/c1-31(2,3)23-13-15-25(16-14-23)38-20-28(36)33-32-18-22-19-35(24-10-5-4-6-11-24)34-29(22)26-17-21-9-7-8-12-27(21)39-30(26)37/h4-19H,20H2,1-3H3,(H,33,36)/b32-18+