N-[[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[[3-(2-oxochromen-3-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[3-(2-oxo-1-benzopyran-3-yl)-1-phenyl-4-pyrazolyl]methylideneamino]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[[3-(2-oxochromen-3-yl)-1-phenylpyrazol-4-yl]methylideneamino]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[[3-(2-ketochromen-3-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]-piperonylamide Formula: C27H18N4O5 MolecularWeight: 478.45562

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NN=CC3=CN(N=C3C4=CC5=CC=CC=C5OC4=O)C6=CC=CC=C6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NN=CC3=CN(N=C3C4=CC5=CC=CC=C5OC4=O)C6=CC=CC=C6

InChI

InChI=1S/C27H18N4O5/c32-26(18-10-11-23-24(13-18)35-16-34-23)29-28-14-19-15-31(20-7-2-1-3-8-20)30-25(19)21-12-17-6-4-5-9-22(17)36-27(21)33/h1-15H,16H2,(H,29,32)