ethyl 4-[[(1Z)-1-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)ethyl]amino]benzoate

Systemtic Name: ethyl 4-[[(1Z)-1-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)ethyl]amino]benzoate Openeye Name: ethyl 4-[[(1Z)-1-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)ethyl]amino]benzoate CAS Name: 4-[[(1Z)-1-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(1Z)-1-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)ethyl]amino]benzoate Traditional Name: 4-[[(1Z)-1-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)ethyl]amino]benzoic acid ethyl ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=C2C(=NN(C2=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N/C(=C\2/C(=NN(C2=O)C3=CC=CC=C3)C)/C

InChI

InChI=1S/C21H21N3O3/c1-4-27-21(26)16-10-12-17(13-11-16)22-14(2)19-15(3)23-24(20(19)25)18-8-6-5-7-9-18/h5-13,22H,4H2,1-3H3/b19-14-