(E)-3-[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (E)-3-[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-N-benzyl-3-[3-(2-oxochromen-3-yl)-1-phenyl-pyrazol-4-yl]prop-2-enamide CAS Name: (E)-3-[3-(2-oxo-1-benzopyran-3-yl)-1-phenyl-4-pyrazolyl]-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-N-benzyl-3-[3-(2-oxochromen-3-yl)-1-phenylpyrazol-4-yl]prop-2-enamide Traditional Name: (E)-N-benzyl-3-[3-(2-ketochromen-3-yl)-1-phenyl-pyrazol-4-yl]acrylamide Formula: C28H21N3O3 MolecularWeight: 447.48464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C=CC2=CN(N=C2C3=CC4=CC=CC=C4OC3=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)/C=C/C2=CN(N=C2C3=CC4=CC=CC=C4OC3=O)C5=CC=CC=C5

InChI

InChI=1S/C28H21N3O3/c32-26(29-18-20-9-3-1-4-10-20)16-15-22-19-31(23-12-5-2-6-13-23)30-27(22)24-17-21-11-7-8-14-25(21)34-28(24)33/h1-17,19H,18H2,(H,29,32)/b16-15+