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

Systemtic Name: ethyl 1-methyl-5-[2-(4-oxidanylidene-2-phenyl-chromen-3-yl)oxybutanoylamino]pyrazole-4-carboxylate Openeye Name: ethyl 1-methyl-5-[2-(4-oxo-2-phenyl-chromen-3-yl)oxybutanoylamino]pyrazole-4-carboxylate CAS Name: 1-methyl-5-[[1-oxo-2-[(4-oxo-2-phenyl-1-benzopyran-3-yl)oxy]butyl]amino]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-5-[2-(4-oxo-2-phenylchromen-3-yl)oxybutanoylamino]pyrazole-4-carboxylate Traditional Name: 5-[2-(4-keto-2-phenyl-chromen-3-yl)oxybutanoylamino]-1-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C26H25N3O6 MolecularWeight: 475.4932

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=NN1C)C(=O)OCC)OC2=C(OC3=CC=CC=C3C2=O)C4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)NC1=C(C=NN1C)C(=O)OCC)OC2=C(OC3=CC=CC=C3C2=O)C4=CC=CC=C4

InChI

InChI=1S/C26H25N3O6/c1-4-19(25(31)28-24-18(15-27-29(24)3)26(32)33-5-2)34-23-21(30)17-13-9-10-14-20(17)35-22(23)16-11-7-6-8-12-16/h6-15,19H,4-5H2,1-3H3,(H,28,31)