(2S)-1-[2-(5-methoxy-4,7-dimethyl-2-oxidanylidene-chromen-3-yl)ethanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (2S)-1-[2-(5-methoxy-4,7-dimethyl-2-oxidanylidene-chromen-3-yl)ethanoyl]pyrrolidine-2-carboxylate Openeye Name: (2S)-1-[2-(5-methoxy-4,7-dimethyl-2-oxo-chromen-3-yl)acetyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[2-(5-methoxy-4,7-dimethyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-[2-(5-methoxy-4,7-dimethyl-2-oxochromen-3-yl)acetyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[2-(2-keto-5-methoxy-4,7-dimethyl-chromen-3-yl)acetyl]pyrrolidine-2-carboxylate Formula: C19H20NO6- MolecularWeight: 358.3652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC(=O)N3CCCC3C(=O)[O-])C)C(=C1)OC

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC(=O)N3CCC[C@H]3C(=O)[O-])C)C(=C1)OC

InChI

InChI=1S/C19H21NO6/c1-10-7-14(25-3)17-11(2)12(19(24)26-15(17)8-10)9-16(21)20-6-4-5-13(20)18(22)23/h7-8,13H,4-6,9H2,1-3H3,(H,22,23)/p-1/t13-/m0/s1