[2-[[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-pentyl-azanium

Systemtic Name: [2-[[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-pentyl-azanium Openeye Name: [2-[[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-pentyl-ammonium CAS Name: [2-[[5-tert-butyl-2-(2-chlorophenyl)-3-pyrazolyl]amino]-2-oxoethyl]-pentylammonium IUPAC Name: [2-[[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]amino]-2-oxoethyl]-pentylazanium Traditional Name: amyl-[2-[[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]amino]-2-keto-ethyl]ammonium Formula: C20H30ClN4O+ MolecularWeight: 377.9314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH2+]CC(=O)NC1=CC(=NN1C2=CC=CC=C2Cl)C(C)(C)C

Isomeric SMILES

CCCCC[NH2+]CC(=O)NC1=CC(=NN1C2=CC=CC=C2Cl)C(C)(C)C

InChI

InChI=1S/C20H29ClN4O/c1-5-6-9-12-22-14-19(26)23-18-13-17(20(2,3)4)24-25(18)16-11-8-7-10-15(16)21/h7-8,10-11,13,22H,5-6,9,12,14H2,1-4H3,(H,23,26)/p+1