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

Systemtic Name: 3-[(4Z)-4-[[4-(dipropylamino)phenyl]methylidene]-3-methylidene-5-oxidanylidene-pyrazolidin-1-yl]benzoic acid Openeye Name: 3-[(4Z)-4-[[4-(dipropylamino)phenyl]methylene]-3-methylene-5-oxo-pyrazolidin-1-yl]benzoic acid CAS Name: 3-[(4Z)-4-[[4-(dipropylamino)phenyl]methylidene]-3-methylene-5-oxo-1-pyrazolidinyl]benzoic acid IUPAC Name: 3-[(4Z)-4-[[4-(dipropylamino)phenyl]methylidene]-3-methylidene-5-oxopyrazolidin-1-yl]benzoic acid Traditional Name: 3-[(4Z)-4-[4-(dipropylamino)benzylidene]-5-keto-3-methylene-pyrazolidin-1-yl]benzoic acid Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=CC=C(C=C1)C=C2C(=C)NN(C2=O)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C24H27N3O3/c1-4-13-26(14-5-2)20-11-9-18(10-12-20)15-22-17(3)25-27(23(22)28)21-8-6-7-19(16-21)24(29)30/h6-12,15-16,25H,3-5,13-14H2,1-2H3,(H,29,30)/b22-15-