3-[(4Z)-4-[(4-dimethylaminophenyl)methylidene]-3-methylidene-5-oxidanylidene-pyrazolidin-1-yl]benzoic acid

Systemtic Name: 3-[(4Z)-4-[(4-dimethylaminophenyl)methylidene]-3-methylidene-5-oxidanylidene-pyrazolidin-1-yl]benzoic acid Openeye Name: 3-[(4Z)-4-[(4-dimethylaminophenyl)methylene]-3-methylene-5-oxo-pyrazolidin-1-yl]benzoic acid CAS Name: 3-[(4Z)-4-[(4-dimethylaminophenyl)methylidene]-3-methylene-5-oxo-1-pyrazolidinyl]benzoic acid IUPAC Name: 3-[(4Z)-4-[(4-dimethylaminophenyl)methylidene]-3-methylidene-5-oxopyrazolidin-1-yl]benzoic acid Traditional Name: 3-[(4Z)-4-[4-(dimethylamino)benzylidene]-5-keto-3-methylene-pyrazolidin-1-yl]benzoic acid Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=C2C(=C)NN(C2=O)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O3/c1-13-18(11-14-7-9-16(10-8-14)22(2)3)19(24)23(21-13)17-6-4-5-15(12-17)20(25)26/h4-12,21H,1H2,2-3H3,(H,25,26)/b18-11-