ethyl 4-[[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-methyl-amino]diazenyl]benzoate

Systemtic Name: ethyl 4-[[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-methyl-amino]diazenyl]benzoate Openeye Name: ethyl 4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-methyl-amino]azobenzoate CAS Name: 4-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-methylamino]azobenzoic acid ethyl ester IUPAC Name: ethyl 4-[[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-methylamino]diazenyl]benzoate Traditional Name: 4-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-methyl-amino]azobenzoic acid ethyl ester Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=NN(C)C2=C(N(N(C2=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=NN(C)C2=C(N(N(C2=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C21H23N5O3/c1-5-29-21(28)16-11-13-17(14-12-16)22-23-24(3)19-15(2)25(4)26(20(19)27)18-9-7-6-8-10-18/h6-14H,5H2,1-4H3