(2S)-1-[2-(4-ethyl-2-oxidanylidene-chromen-7-yl)oxyethanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (2S)-1-[2-(4-ethyl-2-oxidanylidene-chromen-7-yl)oxyethanoyl]pyrrolidine-2-carboxylate Openeye Name: (2S)-1-[2-(4-ethyl-2-oxo-chromen-7-yl)oxyacetyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[2-[(4-ethyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-[2-(4-ethyl-2-oxochromen-7-yl)oxyacetyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[2-(4-ethyl-2-keto-chromen-7-yl)oxyacetyl]pyrrolidine-2-carboxylate Formula: C18H18NO6- MolecularWeight: 344.33862

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)N3CCCC3C(=O)[O-]

Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)N3CCC[C@H]3C(=O)[O-]

InChI

InChI=1S/C18H19NO6/c1-2-11-8-17(21)25-15-9-12(5-6-13(11)15)24-10-16(20)19-7-3-4-14(19)18(22)23/h5-6,8-9,14H,2-4,7,10H2,1H3,(H,22,23)/p-1/t14-/m0/s1