(4-methanoyl-2-methoxy-phenyl) 3-[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoate

Systemtic Name: (4-methanoyl-2-methoxy-phenyl) 3-[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoate Openeye Name: (4-formyl-2-methoxy-phenyl) 3-[3-(2-oxochromen-3-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoate CAS Name: 3-[3-(2-oxo-1-benzopyran-3-yl)-1-phenyl-4-pyrazolyl]-2-propenoic acid (4-formyl-2-methoxyphenyl) ester IUPAC Name: (4-formyl-2-methoxyphenyl) 3-[3-(2-oxochromen-3-yl)-1-phenylpyrazol-4-yl]prop-2-enoate Traditional Name: 3-[3-(2-ketochromen-3-yl)-1-phenyl-pyrazol-4-yl]acrylic acid (4-formyl-2-methoxy-phenyl) ester Formula: C29H20N2O6 MolecularWeight: 492.4789

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=O)OC(=O)C=CC2=CN(N=C2C3=CC4=CC=CC=C4OC3=O)C5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)C=O)OC(=O)C=CC2=CN(N=C2C3=CC4=CC=CC=C4OC3=O)C5=CC=CC=C5

InChI

InChI=1S/C29H20N2O6/c1-35-26-15-19(18-32)11-13-25(26)36-27(33)14-12-21-17-31(22-8-3-2-4-9-22)30-28(21)23-16-20-7-5-6-10-24(20)37-29(23)34/h2-18H,1H3