(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 4-(2-oxidanylidenepyrrolidin-1-yl)benzoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 4-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 4-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 4-(2-oxo-1-pyrrolidinyl)benzoic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 4-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 4-(2-ketopyrrolidino)benzoic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C23H21NO5 MolecularWeight: 391.41654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC=C(C=C3)N4CCCC4=O)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC=C(C=C3)N4CCCC4=O)C

InChI

InChI=1S/C23H21NO5/c1-14-10-19-17(12-22(26)29-20(19)11-15(14)2)13-28-23(27)16-5-7-18(8-6-16)24-9-3-4-21(24)25/h5-8,10-12H,3-4,9,13H2,1-2H3