(2R)-2-[3-(3-tert-butyl-5-methyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)propanoylamino]hexanoate

Systemtic Name: (2R)-2-[3-(3-tert-butyl-5-methyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)propanoylamino]hexanoate Openeye Name: (2R)-2-[3-(3-tert-butyl-5-methyl-7-oxo-furo[3,2-g]chromen-6-yl)propanoylamino]hexanoate CAS Name: (2R)-2-[[3-(3-tert-butyl-5-methyl-7-oxo-6-furo[3,2-g][1]benzopyranyl)-1-oxopropyl]amino]hexanoate IUPAC Name: (2R)-2-[3-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]hexanoate Traditional Name: (2R)-2-[3-(3-tert-butyl-7-keto-5-methyl-furo[3,2-g]chromen-6-yl)propanoylamino]hexanoate Formula: C25H30NO6- MolecularWeight: 440.5088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)[O-])NC(=O)CCC1=C(C2=C(C=C3C(=C2)C(=CO3)C(C)(C)C)OC1=O)C

Isomeric SMILES

CCCC[C@H](C(=O)[O-])NC(=O)CCC1=C(C2=C(C=C3C(=C2)C(=CO3)C(C)(C)C)OC1=O)C

InChI

InChI=1S/C25H31NO6/c1-6-7-8-19(23(28)29)26-22(27)10-9-15-14(2)16-11-17-18(25(3,4)5)13-31-20(17)12-21(16)32-24(15)30/h11-13,19H,6-10H2,1-5H3,(H,26,27)(H,28,29)/p-1/t19-/m1/s1