4-[(4Z)-3-methanoyl-4-[[1-(1-methoxy-1-oxidanylidene-propan-2-yl)indol-3-yl]methylidene]-5-oxidanylidene-pyrazol-1-yl]benzoic acid

Systemtic Name: 4-[(4Z)-3-methanoyl-4-[[1-(1-methoxy-1-oxidanylidene-propan-2-yl)indol-3-yl]methylidene]-5-oxidanylidene-pyrazol-1-yl]benzoic acid Openeye Name: 4-[(4Z)-3-formyl-4-[[1-(2-methoxy-1-methyl-2-oxo-ethyl)indol-3-yl]methylene]-5-oxo-pyrazol-1-yl]benzoic acid CAS Name: 4-[(4Z)-3-formyl-4-[[1-(1-methoxy-1-oxopropan-2-yl)-3-indolyl]methylidene]-5-oxo-1-pyrazolyl]benzoic acid IUPAC Name: 4-[(4Z)-3-formyl-4-[[1-(1-methoxy-1-oxopropan-2-yl)indol-3-yl]methylidene]-5-oxopyrazol-1-yl]benzoic acid Traditional Name: 4-[(4Z)-3-formyl-5-keto-4-[[1-(2-keto-2-methoxy-1-methyl-ethyl)indol-3-yl]methylene]-2-pyrazolin-1-yl]benzoic acid Formula: C24H19N3O6 MolecularWeight: 445.42416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)N1C=C(C2=CC=CC=C21)C=C3C(=NN(C3=O)C4=CC=C(C=C4)C(=O)O)C=O

Isomeric SMILES

CC(C(=O)OC)N1C=C(C2=CC=CC=C21)/C=C\3/C(=NN(C3=O)C4=CC=C(C=C4)C(=O)O)C=O

InChI

InChI=1S/C24H19N3O6/c1-14(24(32)33-2)26-12-16(18-5-3-4-6-21(18)26)11-19-20(13-28)25-27(22(19)29)17-9-7-15(8-10-17)23(30)31/h3-14H,1-2H3,(H,30,31)/b19-11-