[6-ethyl-4-oxidanylidene-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: [6-ethyl-4-oxidanylidene-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: [6-ethyl-4-oxo-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] (2S)-2-(tert-butoxycarbonylamino)propanoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid [6-ethyl-4-oxo-3-phenoxy-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [6-ethyl-4-oxo-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)propionic acid [6-ethyl-4-keto-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] ester Formula: C26H26F3NO7 MolecularWeight: 521.48235

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC=CC=C3)OC(=O)C(C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC=CC=C3)OC(=O)[C@H](C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C26H26F3NO7/c1-6-15-12-17-19(13-18(15)36-23(32)14(2)30-24(33)37-25(3,4)5)35-22(26(27,28)29)21(20(17)31)34-16-10-8-7-9-11-16/h7-14H,6H2,1-5H3,(H,30,33)/t14-/m0/s1