(4-methyl-2-oxidanylidene-chromen-7-yl) (3R)-1-(4-bromanyl-2-methyl-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (4-methyl-2-oxidanylidene-chromen-7-yl) (3R)-1-(4-bromanyl-2-methyl-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (4-methyl-2-oxo-chromen-7-yl) (3R)-1-(4-bromo-2-methyl-phenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3R)-1-(4-bromo-2-methylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-oxochromen-7-yl) (3R)-1-(4-bromo-2-methylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3R)-1-(4-bromo-2-methyl-phenyl)-5-keto-pyrrolidine-3-carboxylic acid (2-keto-4-methyl-chromen-7-yl) ester Formula: C22H18BrNO5 MolecularWeight: 456.28602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C3CC(=O)N(C3)C4=C(C=C(C=C4)Br)C

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)[C@@H]3CC(=O)N(C3)C4=C(C=C(C=C4)Br)C

InChI

InChI=1S/C22H18BrNO5/c1-12-8-21(26)29-19-10-16(4-5-17(12)19)28-22(27)14-9-20(25)24(11-14)18-6-3-15(23)7-13(18)2/h3-8,10,14H,9,11H2,1-2H3/t14-/m1/s1