methyl 2-[[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]carbonylamino]ethanoate Openeye Name: methyl 2-[[3-(2-oxochromen-3-yl)-1-phenyl-pyrazole-4-carbonyl]amino]acetate CAS Name: 2-[[oxo-[3-(2-oxo-1-benzopyran-3-yl)-1-phenyl-4-pyrazolyl]methyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[3-(2-oxochromen-3-yl)-1-phenylpyrazole-4-carbonyl]amino]acetate Traditional Name: 2-[[3-(2-ketochromen-3-yl)-1-phenyl-pyrazole-4-carbonyl]amino]acetic acid methyl ester Formula: C22H17N3O5 MolecularWeight: 403.38748

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1=CN(N=C1C2=CC3=CC=CC=C3OC2=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CNC(=O)C1=CN(N=C1C2=CC3=CC=CC=C3OC2=O)C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O5/c1-29-19(26)12-23-21(27)17-13-25(15-8-3-2-4-9-15)24-20(17)16-11-14-7-5-6-10-18(14)30-22(16)28/h2-11,13H,12H2,1H3,(H,23,27)