O2-(6-chloranyl-4-ethyl-2-oxidanylidene-chromen-7-yl) O1-(phenylmethyl) (2S)-pyrrolidine-1,2-dicarboxylate

Systemtic Name: O2-(6-chloranyl-4-ethyl-2-oxidanylidene-chromen-7-yl) O1-(phenylmethyl) (2S)-pyrrolidine-1,2-dicarboxylate Openeye Name: O1-benzyl O2-(6-chloro-4-ethyl-2-oxo-chromen-7-yl) (2S)-pyrrolidine-1,2-dicarboxylate CAS Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O2-(6-chloro-4-ethyl-2-oxo-1-benzopyran-7-yl) ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 2-O-(6-chloro-4-ethyl-2-oxochromen-7-yl) (2S)-pyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-benzyl ester O2-(6-chloro-4-ethyl-2-keto-chromen-7-yl) ester Formula: C24H22ClNO6 MolecularWeight: 455.88758

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C3CCCN3C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)[C@@H]3CCCN3C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C24H22ClNO6/c1-2-16-11-22(27)31-20-13-21(18(25)12-17(16)20)32-23(28)19-9-6-10-26(19)24(29)30-14-15-7-4-3-5-8-15/h3-5,7-8,11-13,19H,2,6,9-10,14H2,1H3/t19-/m0/s1