4-[(4Z)-3-ethyl-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-ethyl-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-ethyl-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-ethyl-4-[[1-(1-methoxy-1-oxopropan-2-yl)-3-indolyl]methylidene]-5-oxo-1-pyrazolyl]benzoic acid IUPAC Name: 4-[(4Z)-3-ethyl-4-[[1-(1-methoxy-1-oxopropan-2-yl)indol-3-yl]methylidene]-5-oxopyrazol-1-yl]benzoic acid Traditional Name: 4-[(4Z)-3-ethyl-5-keto-4-[[1-(2-keto-2-methoxy-1-methyl-ethyl)indol-3-yl]methylene]-2-pyrazolin-1-yl]benzoic acid Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=O)C1=CC2=CN(C3=CC=CC=C32)C(C)C(=O)OC)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CCC\1=NN(C(=O)/C1=C\C2=CN(C3=CC=CC=C32)C(C)C(=O)OC)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C25H23N3O5/c1-4-21-20(23(29)28(26-21)18-11-9-16(10-12-18)24(30)31)13-17-14-27(15(2)25(32)33-3)22-8-6-5-7-19(17)22/h5-15H,4H2,1-3H3,(H,30,31)/b20-13-