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

Systemtic Name: 4-[(4Z)-3-azanyl-4-[[5-methoxy-1-(1-methoxy-1-oxidanylidene-propan-2-yl)indol-3-yl]methylidene]-5-oxidanylidene-pyrazol-1-yl]benzoic acid Openeye Name: 4-[(4Z)-3-amino-4-[[5-methoxy-1-(2-methoxy-1-methyl-2-oxo-ethyl)indol-3-yl]methylene]-5-oxo-pyrazol-1-yl]benzoic acid CAS Name: 4-[(4Z)-3-amino-4-[[5-methoxy-1-(1-methoxy-1-oxopropan-2-yl)-3-indolyl]methylidene]-5-oxo-1-pyrazolyl]benzoic acid IUPAC Name: 4-[(4Z)-3-amino-4-[[5-methoxy-1-(1-methoxy-1-oxopropan-2-yl)indol-3-yl]methylidene]-5-oxopyrazol-1-yl]benzoic acid Traditional Name: 4-[(4Z)-3-amino-5-keto-4-[[1-(2-keto-2-methoxy-1-methyl-ethyl)-5-methoxy-indol-3-yl]methylene]-2-pyrazolin-1-yl]benzoic acid Formula: C24H22N4O6 MolecularWeight: 462.45468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)N1C=C(C2=C1C=CC(=C2)OC)C=C3C(=NN(C3=O)C4=CC=C(C=C4)C(=O)O)N

Isomeric SMILES

CC(C(=O)OC)N1C=C(C2=C1C=CC(=C2)OC)/C=C\3/C(=NN(C3=O)C4=CC=C(C=C4)C(=O)O)N

InChI

InChI=1S/C24H22N4O6/c1-13(24(32)34-3)27-12-15(18-11-17(33-2)8-9-20(18)27)10-19-21(25)26-28(22(19)29)16-6-4-14(5-7-16)23(30)31/h4-13H,1-3H3,(H2,25,26)(H,30,31)/b19-10-