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

Systemtic Name: ethyl 5-[2-[2-(4-tert-butylphenyl)-4-oxidanylidene-chromen-3-yl]oxybutanoylamino]-1-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[2-[2-(4-tert-butylphenyl)-4-oxo-chromen-3-yl]oxybutanoylamino]-1-methyl-pyrazole-4-carboxylate CAS Name: 5-[[2-[[2-(4-tert-butylphenyl)-4-oxo-1-benzopyran-3-yl]oxy]-1-oxobutyl]amino]-1-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[2-(4-tert-butylphenyl)-4-oxochromen-3-yl]oxybutanoylamino]-1-methylpyrazole-4-carboxylate Traditional Name: 5-[2-[2-(4-tert-butylphenyl)-4-keto-chromen-3-yl]oxybutanoylamino]-1-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C30H33N3O6 MolecularWeight: 531.59952

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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=C(C=C4)C(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C30H33N3O6/c1-7-22(28(35)32-27-21(17-31-33(27)6)29(36)37-8-2)38-26-24(34)20-11-9-10-12-23(20)39-25(26)18-13-15-19(16-14-18)30(3,4)5/h9-17,22H,7-8H2,1-6H3,(H,32,35)