ethyl 5-(azocan-1-ylsulfonyl)-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(azocan-1-ylsulfonyl)-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-(azocan-1-ylsulfonyl)-1H-pyrazole-4-carboxylate CAS Name: 5-(1-azocanylsulfonyl)-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(azocan-1-ylsulfonyl)-1H-pyrazole-4-carboxylate Traditional Name: 5-(azocan-1-ylsulfonyl)-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C13H21N3O4S MolecularWeight: 315.38854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1)S(=O)(=O)N2CCCCCCC2

Isomeric SMILES

CCOC(=O)C1=C(NN=C1)S(=O)(=O)N2CCCCCCC2

InChI

InChI=1S/C13H21N3O4S/c1-2-20-13(17)11-10-14-15-12(11)21(18,19)16-8-6-4-3-5-7-9-16/h10H,2-9H2,1H3,(H,14,15)