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

Systemtic Name: propyl 4-[[(Z)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]amino]benzoate Openeye Name: propyl 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 propyl ester IUPAC Name: propyl 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 propyl ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O3/c1-3-13-27-21(26)16-9-11-17(12-10-16)22-14-19-15(2)23-24(20(19)25)18-7-5-4-6-8-18/h4-12,14,22H,3,13H2,1-2H3/b19-14-