[2-acetyloxy-5-(3,5,7-triacetyloxy-4-oxidanylidene-chromen-2-yl)phenyl] 4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexane-1-carboxylate

Systemtic Name: [2-acetyloxy-5-(3,5,7-triacetyloxy-4-oxidanylidene-chromen-2-yl)phenyl] 4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexane-1-carboxylate Openeye Name: [2-acetoxy-5-(3,5,7-triacetoxy-4-oxo-chromen-2-yl)phenyl] 4-(tert-butoxycarbonylamino)cyclohexanecarboxylate CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-cyclohexanecarboxylic acid [2-acetyloxy-5-(3,5,7-triacetyloxy-4-oxo-1-benzopyran-2-yl)phenyl] ester IUPAC Name: [2-acetyloxy-5-(3,5,7-triacetyloxy-4-oxochromen-2-yl)phenyl] 4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexane-1-carboxylate Traditional Name: 4-(tert-butoxycarbonylamino)cyclohexanecarboxylic acid [2-acetoxy-5-(3,5,7-triacetoxy-4-keto-chromen-2-yl)phenyl] ester Formula: C35H37NO14 MolecularWeight: 695.66658

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C4CCC(CC4)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C4CCC(CC4)NC(=O)OC(C)(C)C

InChI

InChI=1S/C35H37NO14/c1-17(37)44-24-15-27(46-19(3)39)29-28(16-24)48-31(32(30(29)41)47-20(4)40)22-10-13-25(45-18(2)38)26(14-22)49-33(42)21-8-11-23(12-9-21)36-34(43)50-35(5,6)7/h10,13-16,21,23H,8-9,11-12H2,1-7H3,(H,36,43)