3-(azepan-1-yl)-5-methyl-1H-pyrazole-4-carboxylic acid

Systemtic Name: 3-(azepan-1-yl)-5-methyl-1H-pyrazole-4-carboxylic acid Openeye Name: 3-(azepan-1-yl)-5-methyl-1H-pyrazole-4-carboxylic acid CAS Name: 3-(1-azepanyl)-5-methyl-1H-pyrazole-4-carboxylic acid IUPAC Name: 3-(azepan-1-yl)-5-methyl-1H-pyrazole-4-carboxylic acid Traditional Name: 3-(azepan-1-yl)-5-methyl-1H-pyrazole-4-carboxylic acid Formula: C11H17N3O2 MolecularWeight: 223.27158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)N2CCCCCC2)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1)N2CCCCCC2)C(=O)O

InChI

InChI=1S/C11H17N3O2/c1-8-9(11(15)16)10(13-12-8)14-6-4-2-3-5-7-14/h2-7H2,1H3,(H,12,13)(H,15,16)