6-[3-(3,5-dimethyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)propanoylamino]hexanoate

Systemtic Name: 6-[3-(3,5-dimethyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)propanoylamino]hexanoate Openeye Name: 6-[3-(3,5-dimethyl-7-oxo-furo[3,2-g]chromen-6-yl)propanoylamino]hexanoate CAS Name: 6-[[3-(3,5-dimethyl-7-oxo-6-furo[3,2-g][1]benzopyranyl)-1-oxopropyl]amino]hexanoate IUPAC Name: 6-[3-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]hexanoate Traditional Name: 6-[3-(7-keto-3,5-dimethyl-furo[3,2-g]chromen-6-yl)propanoylamino]hexanoate Formula: C22H24NO6- MolecularWeight: 398.42906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC2=CC3=C(C=C12)C(=C(C(=O)O3)CCC(=O)NCCCCCC(=O)[O-])C

Isomeric SMILES

CC1=COC2=CC3=C(C=C12)C(=C(C(=O)O3)CCC(=O)NCCCCCC(=O)[O-])C

InChI

InChI=1S/C22H25NO6/c1-13-12-28-18-11-19-17(10-16(13)18)14(2)15(22(27)29-19)7-8-20(24)23-9-5-3-4-6-21(25)26/h10-12H,3-9H2,1-2H3,(H,23,24)(H,25,26)/p-1