1-[3-(cyclooctylamino)-3-oxidanylidene-propyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[3-(cyclooctylamino)-3-oxidanylidene-propyl]pyrazole-4-carboxylic acid Openeye Name: 1-[3-(cyclooctylamino)-3-oxo-propyl]pyrazole-4-carboxylic acid CAS Name: 1-[3-(cyclooctylamino)-3-oxopropyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[3-(cyclooctylamino)-3-oxopropyl]pyrazole-4-carboxylic acid Traditional Name: 1-[3-(cyclooctylamino)-3-keto-propyl]pyrazole-4-carboxylic acid Formula: C15H23N3O3 MolecularWeight: 293.36142

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CCN2C=C(C=N2)C(=O)O

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CCN2C=C(C=N2)C(=O)O

InChI

InChI=1S/C15H23N3O3/c19-14(17-13-6-4-2-1-3-5-7-13)8-9-18-11-12(10-16-18)15(20)21/h10-11,13H,1-9H2,(H,17,19)(H,20,21)