(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: 1-(4-chlorophenyl)sulfonyl-2-pyrrolidinecarboxylic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C25H20ClNO6S MolecularWeight: 497.9474

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)OCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)OCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4

InChI

InChI=1S/C25H20ClNO6S/c26-18-8-10-19(11-9-18)34(30,31)27-13-3-6-21(27)25(29)32-15-17-14-23(28)33-22-12-7-16-4-1-2-5-20(16)24(17)22/h1-2,4-5,7-12,14,21H,3,6,13,15H2