6-ethyl-7-phenylmethoxy-3-(1-phenylpyrazol-4-yl)chromen-4-one

Systemtic Name: 6-ethyl-7-phenylmethoxy-3-(1-phenylpyrazol-4-yl)chromen-4-one Openeye Name: 7-benzyloxy-6-ethyl-3-(1-phenylpyrazol-4-yl)chromen-4-one CAS Name: 6-ethyl-7-phenylmethoxy-3-(1-phenyl-4-pyrazolyl)-1-benzopyran-4-one IUPAC Name: 6-ethyl-7-phenylmethoxy-3-(1-phenylpyrazol-4-yl)chromen-4-one Traditional Name: 7-benzoxy-6-ethyl-3-(1-phenylpyrazol-4-yl)chromone Formula: C27H22N2O3 MolecularWeight: 422.47518

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CN(N=C3)C4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CN(N=C3)C4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C27H22N2O3/c1-2-20-13-23-26(14-25(20)31-17-19-9-5-3-6-10-19)32-18-24(27(23)30)21-15-28-29(16-21)22-11-7-4-8-12-22/h3-16,18H,2,17H2,1H3