tert-butyl 5-cyclobutyl-3-[2-[2-(4-methoxyphenyl)-4-oxidanylidene-chromen-6-yl]ethanoylamino]pyrazole-1-carboxylate

Systemtic Name: tert-butyl 5-cyclobutyl-3-[2-[2-(4-methoxyphenyl)-4-oxidanylidene-chromen-6-yl]ethanoylamino]pyrazole-1-carboxylate Openeye Name: tert-butyl 5-cyclobutyl-3-[[2-[2-(4-methoxyphenyl)-4-oxo-chromen-6-yl]acetyl]amino]pyrazole-1-carboxylate CAS Name: 5-cyclobutyl-3-[[2-[2-(4-methoxyphenyl)-4-oxo-1-benzopyran-6-yl]-1-oxoethyl]amino]-1-pyrazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-cyclobutyl-3-[[2-[2-(4-methoxyphenyl)-4-oxochromen-6-yl]acetyl]amino]pyrazole-1-carboxylate Traditional Name: 5-cyclobutyl-3-[[2-[4-keto-2-(4-methoxyphenyl)chromen-6-yl]acetyl]amino]pyrazole-1-carboxylic acid tert-butyl ester Formula: C30H31N3O6 MolecularWeight: 529.58364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(=CC(=N1)NC(=O)CC2=CC3=C(C=C2)OC(=CC3=O)C4=CC=C(C=C4)OC)C5CCC5

Isomeric SMILES

CC(C)(C)OC(=O)N1C(=CC(=N1)NC(=O)CC2=CC3=C(C=C2)OC(=CC3=O)C4=CC=C(C=C4)OC)C5CCC5

InChI

InChI=1S/C30H31N3O6/c1-30(2,3)39-29(36)33-23(19-6-5-7-19)16-27(32-33)31-28(35)15-18-8-13-25-22(14-18)24(34)17-26(38-25)20-9-11-21(37-4)12-10-20/h8-14,16-17,19H,5-7,15H2,1-4H3,(H,31,32,35)