2-[[3-methylidene-1-(2-methylphenyl)-5-oxidanylidene-pyrazolidin-4-ylidene]methylamino]benzoic acid

Systemtic Name: 2-[[3-methylidene-1-(2-methylphenyl)-5-oxidanylidene-pyrazolidin-4-ylidene]methylamino]benzoic acid Openeye Name: 2-[[3-methylene-1-(o-tolyl)-5-oxo-pyrazolidin-4-ylidene]methylamino]benzoic acid CAS Name: 2-[[3-methylene-1-(2-methylphenyl)-5-oxo-4-pyrazolidinylidene]methylamino]benzoic acid IUPAC Name: 2-[[3-methylidene-1-(2-methylphenyl)-5-oxopyrazolidin-4-ylidene]methylamino]benzoic acid Traditional Name: 2-[[5-keto-3-methylene-1-(o-tolyl)pyrazolidin-4-ylidene]methylamino]benzoic acid Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C(=CNC3=CC=CC=C3C(=O)O)C(=C)N2

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C(=CNC3=CC=CC=C3C(=O)O)C(=C)N2

InChI

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