2-diethylaminoethyl 4-[(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)diazenyl]benzoate

Systemtic Name: 2-diethylaminoethyl 4-[(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)diazenyl]benzoate Openeye Name: 2-diethylaminoethyl 4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)azo]benzoate CAS Name: 4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)azo]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]benzoate Traditional Name: 4-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl)azo]benzoic acid 2-diethylaminoethyl ester Formula: C23H27N5O3 MolecularWeight: 421.49218

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)N=NC2C(=NN(C2=O)C3=CC=CC=C3)C

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)N=NC2C(=NN(C2=O)C3=CC=CC=C3)C

InChI

InChI=1S/C23H27N5O3/c1-4-27(5-2)15-16-31-23(30)18-11-13-19(14-12-18)24-25-21-17(3)26-28(22(21)29)20-9-7-6-8-10-20/h6-14,21H,4-5,15-16H2,1-3H3