(2S)-1-[2-(3,5,9-trimethyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)ethanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (2S)-1-[2-(3,5,9-trimethyl-7-oxidanylidene-furo[3,2-g]chromen-6-yl)ethanoyl]pyrrolidine-2-carboxylate Openeye Name: (2S)-1-[2-(3,5,9-trimethyl-7-oxo-furo[3,2-g]chromen-6-yl)acetyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[1-oxo-2-(3,5,9-trimethyl-7-oxo-6-furo[3,2-g][1]benzopyranyl)ethyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-[2-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[2-(7-keto-3,5,9-trimethyl-furo[3,2-g]chromen-6-yl)acetyl]pyrrolidine-2-carboxylate Formula: C21H20NO6- MolecularWeight: 382.3866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC2=C(C3=C(C=C12)C(=C(C(=O)O3)CC(=O)N4CCCC4C(=O)[O-])C)C

Isomeric SMILES

CC1=COC2=C(C3=C(C=C12)C(=C(C(=O)O3)CC(=O)N4CCC[C@H]4C(=O)[O-])C)C

InChI

InChI=1S/C21H21NO6/c1-10-9-27-18-12(3)19-14(7-13(10)18)11(2)15(21(26)28-19)8-17(23)22-6-4-5-16(22)20(24)25/h7,9,16H,4-6,8H2,1-3H3,(H,24,25)/p-1/t16-/m0/s1