(2S)-1-[2-(4,8-dimethyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (2S)-1-[2-(4,8-dimethyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoyl]pyrrolidine-2-carboxylate Openeye Name: (2S)-1-[2-(7-hydroxy-4,8-dimethyl-2-oxo-chromen-3-yl)acetyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[2-(7-hydroxy-4,8-dimethyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-[2-(7-hydroxy-4,8-dimethyl-2-oxochromen-3-yl)acetyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[2-(7-hydroxy-2-keto-4,8-dimethyl-chromen-3-yl)acetyl]pyrrolidine-2-carboxylate Formula: C18H18NO6- MolecularWeight: 344.33862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CC(=O)N3CCCC3C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CC(=O)N3CCC[C@H]3C(=O)[O-]

InChI

InChI=1S/C18H19NO6/c1-9-11-5-6-14(20)10(2)16(11)25-18(24)12(9)8-15(21)19-7-3-4-13(19)17(22)23/h5-6,13,20H,3-4,7-8H2,1-2H3,(H,22,23)/p-1/t13-/m0/s1