1-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]pyrazole-4-carboxylic acid Openeye Name: 1-[2-(cyclooctylamino)-2-oxo-ethyl]pyrazole-4-carboxylic acid CAS Name: 1-[2-(cyclooctylamino)-2-oxoethyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[2-(cyclooctylamino)-2-oxoethyl]pyrazole-4-carboxylic acid Traditional Name: 1-[2-(cyclooctylamino)-2-keto-ethyl]pyrazole-4-carboxylic acid Formula: C14H21N3O3 MolecularWeight: 279.33484

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CN2C=C(C=N2)C(=O)O

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CN2C=C(C=N2)C(=O)O

InChI

InChI=1S/C14H21N3O3/c18-13(10-17-9-11(8-15-17)14(19)20)16-12-6-4-2-1-3-5-7-12/h8-9,12H,1-7,10H2,(H,16,18)(H,19,20)