2-methyl-5-[5-(2-methyl-4-methylidene-5-oxidanylidene-oxolan-2-yl)pentoxy]pyrazole-3-carboxylic acid

Systemtic Name: 2-methyl-5-[5-(2-methyl-4-methylidene-5-oxidanylidene-oxolan-2-yl)pentoxy]pyrazole-3-carboxylic acid Openeye Name: 2-methyl-5-[5-(2-methyl-4-methylene-5-oxo-tetrahydrofuran-2-yl)pentoxy]pyrazole-3-carboxylic acid CAS Name: 2-methyl-5-[5-(2-methyl-4-methylene-5-oxo-2-oxolanyl)pentoxy]-3-pyrazolecarboxylic acid IUPAC Name: 2-methyl-5-[5-(2-methyl-4-methylidene-5-oxooxolan-2-yl)pentoxy]pyrazole-3-carboxylic acid Traditional Name: 5-[5-(5-keto-2-methyl-4-methylene-tetrahydrofuran-2-yl)pentoxy]-2-methyl-pyrazole-3-carboxylic acid Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C)C(=O)O1)CCCCCOC2=NN(C(=C2)C(=O)O)C

Isomeric SMILES

CC1(CC(=C)C(=O)O1)CCCCCOC2=NN(C(=C2)C(=O)O)C

InChI

InChI=1S/C16H22N2O5/c1-11-10-16(2,23-15(11)21)7-5-4-6-8-22-13-9-12(14(19)20)18(3)17-13/h9H,1,4-8,10H2,2-3H3,(H,19,20)