(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoate

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 4-[(2-oxopyrrolidin-1-yl)methyl]benzoate CAS Name: 4-[(2-oxo-1-pyrrolidinyl)methyl]benzoic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl 4-[(2-oxopyrrolidin-1-yl)methyl]benzoate Traditional Name: 4-[(2-ketopyrrolidino)methyl]benzoic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C23H20ClNO5 MolecularWeight: 425.8616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC=C(C=C3)CN4CCCC4=O)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC=C(C=C3)CN4CCCC4=O)Cl

InChI

InChI=1S/C23H20ClNO5/c1-14-9-20-18(11-19(14)24)17(10-22(27)30-20)13-29-23(28)16-6-4-15(5-7-16)12-25-8-2-3-21(25)26/h4-7,9-11H,2-3,8,12-13H2,1H3