3-[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]chromen-2-one

Systemtic Name: 3-[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]chromen-2-one Openeye Name: 3-[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]chromen-2-one CAS Name: 3-[(E)-1-oxo-3-(1-phenyl-4-pyrazolyl)prop-2-enyl]-1-benzopyran-2-one IUPAC Name: 3-[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]chromen-2-one Traditional Name: 3-[(E)-3-(1-phenylpyrazol-4-yl)acryloyl]coumarin Formula: C21H14N2O3 MolecularWeight: 342.34746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C=CC(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)/C=C/C(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C21H14N2O3/c24-19(18-12-16-6-4-5-9-20(16)26-21(18)25)11-10-15-13-22-23(14-15)17-7-2-1-3-8-17/h1-14H/b11-10+