(2-oxidanylidene-4-phenyl-chromen-7-yl) 4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]cyclohexane-1-carboxylate

Systemtic Name: (2-oxidanylidene-4-phenyl-chromen-7-yl) 4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]cyclohexane-1-carboxylate Openeye Name: (2-oxo-4-phenyl-chromen-7-yl) 4-[(tert-butoxycarbonylamino)methyl]cyclohexanecarboxylate CAS Name: 4-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]-1-cyclohexanecarboxylic acid (2-oxo-4-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (2-oxo-4-phenylchromen-7-yl) 4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[(tert-butoxycarbonylamino)methyl]cyclohexanecarboxylic acid (2-keto-4-phenyl-chromen-7-yl) ester Formula: C28H31NO6 MolecularWeight: 477.54884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1CCC(CC1)C(=O)OC2=CC3=C(C=C2)C(=CC(=O)O3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)NCC1CCC(CC1)C(=O)OC2=CC3=C(C=C2)C(=CC(=O)O3)C4=CC=CC=C4

InChI

InChI=1S/C28H31NO6/c1-28(2,3)35-27(32)29-17-18-9-11-20(12-10-18)26(31)33-21-13-14-22-23(19-7-5-4-6-8-19)16-25(30)34-24(22)15-21/h4-8,13-16,18,20H,9-12,17H2,1-3H3,(H,29,32)