3-[[3-methylidene-1-(4-methylphenyl)-5-oxidanylidene-pyrazolidin-4-ylidene]methylamino]benzoate

Systemtic Name: 3-[[3-methylidene-1-(4-methylphenyl)-5-oxidanylidene-pyrazolidin-4-ylidene]methylamino]benzoate Openeye Name: 3-[[3-methylene-5-oxo-1-(p-tolyl)pyrazolidin-4-ylidene]methylamino]benzoate CAS Name: 3-[[3-methylene-1-(4-methylphenyl)-5-oxo-4-pyrazolidinylidene]methylamino]benzoate IUPAC Name: 3-[[3-methylidene-1-(4-methylphenyl)-5-oxopyrazolidin-4-ylidene]methylamino]benzoate Traditional Name: 3-[[5-keto-3-methylene-1-(p-tolyl)pyrazolidin-4-ylidene]methylamino]benzoate Formula: C19H16N3O3- MolecularWeight: 334.34864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=CNC3=CC=CC(=C3)C(=O)[O-])C(=C)N2

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C(=CNC3=CC=CC(=C3)C(=O)[O-])C(=C)N2

InChI

InChI=1S/C19H17N3O3/c1-12-6-8-16(9-7-12)22-18(23)17(13(2)21-22)11-20-15-5-3-4-14(10-15)19(24)25/h3-11,20-21H,2H2,1H3,(H,24,25)/p-1