[(E)-2-(6-ethoxycarbonyl-2-ethyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)ethenyl]-dimethyl-azanium

Systemtic Name: [(E)-2-(6-ethoxycarbonyl-2-ethyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)ethenyl]-dimethyl-azanium Openeye Name: [(E)-2-(6-ethoxycarbonyl-2-ethyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)vinyl]-dimethyl-ammonium CAS Name: [(E)-2-(6-ethoxycarbonyl-2-ethyl-3-phenyl-7-pyrazolo[1,5-a]pyrimidinyl)ethenyl]-dimethylammonium IUPAC Name: [(E)-2-(6-ethoxycarbonyl-2-ethyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)ethenyl]-dimethylazanium Traditional Name: [(E)-2-(6-carbethoxy-2-ethyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)vinyl]-dimethyl-ammonium Formula: C21H25N4O2+ MolecularWeight: 365.4488

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN2C(=C(C=NC2=C1C3=CC=CC=C3)C(=O)OCC)C=C[NH+](C)C

Isomeric SMILES

CCC1=NN2C(=C(C=NC2=C1C3=CC=CC=C3)C(=O)OCC)/C=C/[NH+](C)C

InChI

InChI=1S/C21H24N4O2/c1-5-17-19(15-10-8-7-9-11-15)20-22-14-16(21(26)27-6-2)18(25(20)23-17)12-13-24(3)4/h7-14H,5-6H2,1-4H3/p+1/b13-12+