[[4-ethoxycarbonyl-2-(4-phenylphthalazin-1-yl)pyrazol-3-yl]amino]methylidene-dimethyl-azanium

Systemtic Name: [[4-ethoxycarbonyl-2-(4-phenylphthalazin-1-yl)pyrazol-3-yl]amino]methylidene-dimethyl-azanium Openeye Name: [[4-ethoxycarbonyl-2-(4-phenylphthalazin-1-yl)pyrazol-3-yl]amino]methylene-dimethyl-ammonium CAS Name: [[4-ethoxycarbonyl-2-(4-phenyl-1-phthalazinyl)-3-pyrazolyl]amino]methylidene-dimethylammonium IUPAC Name: [[4-ethoxycarbonyl-2-(4-phenylphthalazin-1-yl)pyrazol-3-yl]amino]methylidene-dimethylazanium Traditional Name: [[4-carbethoxy-2-(4-phenylphthalazin-1-yl)pyrazol-3-yl]amino]methylene-dimethyl-ammonium Formula: C23H23N6O2+ MolecularWeight: 415.46772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4)NC=[N+](C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4)NC=[N+](C)C

InChI

InChI=1S/C23H22N6O2/c1-4-31-23(30)19-14-25-29(21(19)24-15-28(2)3)22-18-13-9-8-12-17(18)20(26-27-22)16-10-6-5-7-11-16/h5-15H,4H2,1-3H3/p+1