(4-methyl-2-oxidanylidene-chromen-6-yl) 3-[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]ethanoylamino]benzoate

Systemtic Name: (4-methyl-2-oxidanylidene-chromen-6-yl) 3-[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]ethanoylamino]benzoate Openeye Name: (4-methyl-2-oxo-chromen-6-yl) 3-[[2-[2,4-bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]benzoate CAS Name: 3-[[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-1-oxoethyl]amino]benzoic acid (4-methyl-2-oxo-1-benzopyran-6-yl) ester IUPAC Name: (4-methyl-2-oxochromen-6-yl) 3-[[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzoate Traditional Name: 3-[[2-(2,4-ditert-amylphenoxy)acetyl]amino]benzoic acid (2-keto-4-methyl-chromen-6-yl) ester Formula: C35H39NO6 MolecularWeight: 569.68726

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC=CC(=C2)C(=O)OC3=CC4=C(C=C3)OC(=O)C=C4C)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC=CC(=C2)C(=O)OC3=CC4=C(C=C3)OC(=O)C=C4C)C(C)(C)CC

InChI

InChI=1S/C35H39NO6/c1-8-34(4,5)24-13-15-30(28(19-24)35(6,7)9-2)40-21-31(37)36-25-12-10-11-23(18-25)33(39)41-26-14-16-29-27(20-26)22(3)17-32(38)42-29/h10-20H,8-9,21H2,1-7H3,(H,36,37)