(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 3-(2-oxidanylidenepyrrolidin-1-yl)benzoate

Systemtic Name: (6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 3-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: (6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl 3-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 3-(2-oxo-1-pyrrolidinyl)benzoic acid (6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl 3-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 3-(2-ketopyrrolidino)benzoic acid (6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C23H21NO6 MolecularWeight: 407.41594

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC(=CC=C3)N4CCCC4=O)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC(=CC=C3)N4CCCC4=O)O

InChI

InChI=1S/C23H21NO6/c1-2-14-10-18-16(11-22(27)30-20(18)12-19(14)25)13-29-23(28)15-5-3-6-17(9-15)24-8-4-7-21(24)26/h3,5-6,9-12,25H,2,4,7-8,13H2,1H3