3-[4-[(4-oxidanylidenechromen-3-ylidene)methyl]-3-phenyl-pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[4-[(4-oxidanylidenechromen-3-ylidene)methyl]-3-phenyl-pyrazol-1-yl]propanenitrile Openeye Name: 3-[4-[(4-oxochroman-3-ylidene)methyl]-3-phenyl-pyrazol-1-yl]propanenitrile CAS Name: 3-[4-[(4-oxo-3,4-dihydro-2H-1-benzopyran-3-ylidene)methyl]-3-phenyl-1-pyrazolyl]propanenitrile IUPAC Name: 3-[4-[(4-oxochromen-3-ylidene)methyl]-3-phenylpyrazol-1-yl]propanenitrile Traditional Name: 3-[4-[(4-ketochroman-3-ylidene)methyl]-3-phenyl-pyrazol-1-yl]propionitrile Formula: C22H17N3O2 MolecularWeight: 355.38928

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CN(N=C2C3=CC=CC=C3)CCC#N)C(=O)C4=CC=CC=C4O1

Isomeric SMILES

C1C(=CC2=CN(N=C2C3=CC=CC=C3)CCC#N)C(=O)C4=CC=CC=C4O1

InChI

InChI=1S/C22H17N3O2/c23-11-6-12-25-14-17(21(24-25)16-7-2-1-3-8-16)13-18-15-27-20-10-5-4-9-19(20)22(18)26/h1-5,7-10,13-14H,6,12,15H2