(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl (3S)-5-oxidanylidene-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl (3S)-5-oxidanylidene-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl (3S)-5-oxo-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate CAS Name: (3S)-5-oxo-1-[(1R)-1-phenylethyl]-3-pyrrolidinecarboxylic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl (3S)-5-oxo-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylic acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C25H25NO5 MolecularWeight: 419.4697

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3CC(=O)N(C3)C(C)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)[C@H]3CC(=O)N(C3)[C@H](C)C4=CC=CC=C4

InChI

InChI=1S/C25H25NO5/c1-3-17-9-10-21-20(13-24(28)31-22(21)11-17)15-30-25(29)19-12-23(27)26(14-19)16(2)18-7-5-4-6-8-18/h4-11,13,16,19H,3,12,14-15H2,1-2H3/t16-,19+/m1/s1