4-[3-(3,5-dimethyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)propanoylamino]butanoate

Systemtic Name: 4-[3-(3,5-dimethyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)propanoylamino]butanoate Openeye Name: 4-[3-(3,5-dimethyl-7-oxo-furo[3,2-g]chromen-6-yl)propanoylamino]butanoate CAS Name: 4-[[3-(3,5-dimethyl-7-oxo-6-furo[3,2-g][1]benzopyranyl)-1-oxopropyl]amino]butanoate IUPAC Name: 4-[3-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]butanoate Traditional Name: 4-[3-(7-keto-3,5-dimethyl-furo[3,2-g]chromen-6-yl)propanoylamino]butyrate Formula: C20H20NO6- MolecularWeight: 370.3759

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO6/c1-11-10-26-16-9-17-15(8-14(11)16)12(2)13(20(25)27-17)5-6-18(22)21-7-3-4-19(23)24/h8-10H,3-7H2,1-2H3,(H,21,22)(H,23,24)/p-1