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

Systemtic Name: butyl 4-[[(Z)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]amino]benzoate Openeye Name: butyl 4-[[(Z)-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]amino]benzoate CAS Name: 4-[[(Z)-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[(Z)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]amino]benzoate Traditional Name: 4-[[(Z)-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]amino]benzoic acid butyl ester Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O3/c1-3-4-14-28-22(27)17-10-12-18(13-11-17)23-15-20-16(2)24-25(21(20)26)19-8-6-5-7-9-19/h5-13,15,23H,3-4,14H2,1-2H3/b20-15-