2-(6-chloranylpyridazin-4-yl)oxycarbonyl-3-(2-cyclopropyl-6-methyl-phenoxy)-2-methyl-pyrrolidine-1-carboxylic acid

Systemtic Name: 2-(6-chloranylpyridazin-4-yl)oxycarbonyl-3-(2-cyclopropyl-6-methyl-phenoxy)-2-methyl-pyrrolidine-1-carboxylic acid Openeye Name: 2-(6-chloropyridazin-4-yl)oxycarbonyl-3-(2-cyclopropyl-6-methyl-phenoxy)-2-methyl-pyrrolidine-1-carboxylic acid CAS Name: 2-[(6-chloro-4-pyridazinyl)oxy-oxomethyl]-3-(2-cyclopropyl-6-methylphenoxy)-2-methyl-1-pyrrolidinecarboxylic acid IUPAC Name: 2-(6-chloropyridazin-4-yl)oxycarbonyl-3-(2-cyclopropyl-6-methylphenoxy)-2-methylpyrrolidine-1-carboxylic acid Traditional Name: 2-(6-chloropyridazin-4-yl)oxycarbonyl-3-(2-cyclopropyl-6-methyl-phenoxy)-2-methyl-pyrrolidine-1-carboxylic acid Formula: C21H22ClN3O5 MolecularWeight: 431.86948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC2CCN(C2(C)C(=O)OC3=CC(=NN=C3)Cl)C(=O)O)C4CC4

Isomeric SMILES

CC1=CC=CC(=C1OC2CCN(C2(C)C(=O)OC3=CC(=NN=C3)Cl)C(=O)O)C4CC4

InChI

InChI=1S/C21H22ClN3O5/c1-12-4-3-5-15(13-6-7-13)18(12)30-16-8-9-25(20(27)28)21(16,2)19(26)29-14-10-17(22)24-23-11-14/h3-5,10-11,13,16H,6-9H2,1-2H3,(H,27,28)