(4-oxidanylidene-3-phenoxy-chromen-7-yl) (2S)-pyrrolidin-1-ium-2-carboxylate

Systemtic Name: (4-oxidanylidene-3-phenoxy-chromen-7-yl) (2S)-pyrrolidin-1-ium-2-carboxylate Openeye Name: (4-oxo-3-phenoxy-chromen-7-yl) (2S)-pyrrolidin-1-ium-2-carboxylate CAS Name: (2S)-2-pyrrolidin-1-iumcarboxylic acid (4-oxo-3-phenoxy-1-benzopyran-7-yl) ester IUPAC Name: (4-oxo-3-phenoxychromen-7-yl) (2S)-pyrrolidin-1-ium-2-carboxylate Traditional Name: (2S)-pyrrolidin-1-ium-2-carboxylic acid (4-keto-3-phenoxy-chromen-7-yl) ester Formula: C20H18NO5+ MolecularWeight: 352.36062

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)OC4=CC=CC=C4

Isomeric SMILES

C1C[C@H]([NH2+]C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)OC4=CC=CC=C4

InChI

InChI=1S/C20H17NO5/c22-19-15-9-8-14(26-20(23)16-7-4-10-21-16)11-17(15)24-12-18(19)25-13-5-2-1-3-6-13/h1-3,5-6,8-9,11-12,16,21H,4,7,10H2/p+1/t16-/m0/s1