(1,2-dimethyl-5-phenyl-pyrazol-3-ylidene)-dipropyl-azanium perchlorate

Systemtic Name: (1,2-dimethyl-5-phenyl-pyrazol-3-ylidene)-dipropyl-azanium perchlorate Openeye Name: (1,2-dimethyl-5-phenyl-pyrazol-3-ylidene)-dipropyl-ammonium perchlorate CAS Name: (1,2-dimethyl-5-phenyl-3-pyrazolylidene)-dipropylammonium perchlorate IUPAC Name: (1,2-dimethyl-5-phenylpyrazol-3-ylidene)-dipropylazanium perchlorate Traditional Name: (1,2-dimethyl-5-phenyl-3-pyrazolin-3-ylidene)-dipropyl-ammonium perchlorate Formula: C17H26ClN3O4 MolecularWeight: 371.85904

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](=C1C=C(N(N1C)C)C2=CC=CC=C2)CCC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCC[N+](=C1C=C(N(N1C)C)C2=CC=CC=C2)CCC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C17H26N3.ClHO4/c1-5-12-20(13-6-2)17-14-16(18(3)19(17)4)15-10-8-7-9-11-15;2-1(3,4)5/h7-11,14H,5-6,12-13H2,1-4H3;(H,2,3,4,5)/q+1;/p-1