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

Systemtic Name: methyl 4-[[(1Z)-1-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)ethyl]amino]benzoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=C(C)NC2=CC=C(C=C2)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC\1=NN(C(=O)/C1=C(/C)\NC2=CC=C(C=C2)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C20H19N3O3/c1-13(21-16-11-9-15(10-12-16)20(25)26-3)18-14(2)22-23(19(18)24)17-7-5-4-6-8-17/h4-12,21H,1-3H3/b18-13-