ethyl 5-[2-(4-oxidanylidene-2-phenyl-chromen-3-yl)oxybutanoylamino]-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[2-(4-oxidanylidene-2-phenyl-chromen-3-yl)oxybutanoylamino]-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[2-(4-oxo-2-phenyl-chromen-3-yl)oxybutanoylamino]-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-[[1-oxo-2-[(4-oxo-2-phenyl-1-benzopyran-3-yl)oxy]butyl]amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(4-oxo-2-phenylchromen-3-yl)oxybutanoylamino]-1-phenylpyrazole-4-carboxylate Traditional Name: 5-[2-(4-keto-2-phenyl-chromen-3-yl)oxybutanoylamino]-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C31H27N3O6 MolecularWeight: 537.56258

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=NN1C2=CC=CC=C2)C(=O)OCC)OC3=C(OC4=CC=CC=C4C3=O)C5=CC=CC=C5

Isomeric SMILES

CCC(C(=O)NC1=C(C=NN1C2=CC=CC=C2)C(=O)OCC)OC3=C(OC4=CC=CC=C4C3=O)C5=CC=CC=C5

InChI

InChI=1S/C31H27N3O6/c1-3-24(30(36)33-29-23(31(37)38-4-2)19-32-34(29)21-15-9-6-10-16-21)39-28-26(35)22-17-11-12-18-25(22)40-27(28)20-13-7-5-8-14-20/h5-19,24H,3-4H2,1-2H3,(H,33,36)