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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23N3O3/c19-14(16-12-6-4-2-1-3-5-7-12)9-11-18-10-8-13(17-18)15(20)21/h8,10,12H,1-7,9,11H2,(H,16,19)(H,20,21)