(E)-carboxy-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)-phenylazanyl-azanium

Systemtic Name: (E)-carboxy-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)-phenylazanyl-azanium Openeye Name: (E)-anilino-carboxy-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)ammonium CAS Name: (E)-anilino-carboxy-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)ammonium IUPAC Name: (E)-anilino-carboxy-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)azanium Traditional Name: (E)-anilino-carboxy-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)ammonium Formula: C17H15N4O3+ MolecularWeight: 323.326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=[N+](C(=O)O)NC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC\1=NN(C(=O)/C1=[N+](\C(=O)O)/NC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H14N4O3/c1-12-15(16(22)20(18-12)14-10-6-3-7-11-14)21(17(23)24)19-13-8-4-2-5-9-13/h2-11H,1H3,(H-,18,19,22,23,24)/p+1