4-[2-(2,3,5,9-tetramethyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)ethanoylamino]butanoate

Systemtic Name: 4-[2-(2,3,5,9-tetramethyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)ethanoylamino]butanoate Openeye Name: 4-[[2-(2,3,5,9-tetramethyl-7-oxo-furo[3,2-g]chromen-6-yl)acetyl]amino]butanoate CAS Name: 4-[[1-oxo-2-(2,3,5,9-tetramethyl-7-oxo-6-furo[3,2-g][1]benzopyranyl)ethyl]amino]butanoate IUPAC Name: 4-[[2-(2,3,5,9-tetramethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]butanoate Traditional Name: 4-[[2-(7-keto-2,3,5,9-tetramethyl-furo[3,2-g]chromen-6-yl)acetyl]amino]butyrate Formula: C21H22NO6- MolecularWeight: 384.40248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C3C(=C(C(=O)OC3=C2C)CC(=O)NCCCC(=O)[O-])C)C

Isomeric SMILES

CC1=C(OC2=C1C=C3C(=C(C(=O)OC3=C2C)CC(=O)NCCCC(=O)[O-])C)C

InChI

InChI=1S/C21H23NO6/c1-10-13(4)27-19-12(3)20-15(8-14(10)19)11(2)16(21(26)28-20)9-17(23)22-7-5-6-18(24)25/h8H,5-7,9H2,1-4H3,(H,22,23)(H,24,25)/p-1