(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-(1-phenylpyrazol-4-yl)ethanoate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-(1-phenylpyrazol-4-yl)ethanoate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-(1-phenylpyrazol-4-yl)acetate CAS Name: 2-(1-phenyl-4-pyrazolyl)acetic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-(1-phenylpyrazol-4-yl)acetate Traditional Name: 2-(1-phenylpyrazol-4-yl)acetic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C25H18N2O4 MolecularWeight: 410.42142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CC(=O)OCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CC(=O)OCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4

InChI

InChI=1S/C25H18N2O4/c28-23(12-17-14-26-27(15-17)20-7-2-1-3-8-20)30-16-19-13-24(29)31-22-11-10-18-6-4-5-9-21(18)25(19)22/h1-11,13-15H,12,16H2