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

Systemtic Name: 4-[(4Z)-3-methyl-5-oxidanylidene-4-[[1-(1-oxidanylidene-1-phenoxy-propan-2-yl)indol-3-yl]methylidene]pyrazol-1-yl]benzoic acid Openeye Name: 4-[(4Z)-3-methyl-4-[[1-(1-methyl-2-oxo-2-phenoxy-ethyl)indol-3-yl]methylene]-5-oxo-pyrazol-1-yl]benzoic acid CAS Name: 4-[(4Z)-3-methyl-5-oxo-4-[[1-(1-oxo-1-phenoxypropan-2-yl)-3-indolyl]methylidene]-1-pyrazolyl]benzoic acid IUPAC Name: 4-[(4Z)-3-methyl-5-oxo-4-[[1-(1-oxo-1-phenoxypropan-2-yl)indol-3-yl]methylidene]pyrazol-1-yl]benzoic acid Traditional Name: 4-[(4Z)-5-keto-4-[[1-(2-keto-1-methyl-2-phenoxy-ethyl)indol-3-yl]methylene]-3-methyl-2-pyrazolin-1-yl]benzoic acid Formula: C29H23N3O5 MolecularWeight: 493.51002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CN(C3=CC=CC=C32)C(C)C(=O)OC4=CC=CC=C4)C5=CC=C(C=C5)C(=O)O

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C2=CN(C3=CC=CC=C32)C(C)C(=O)OC4=CC=CC=C4)C5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C29H23N3O5/c1-18-25(27(33)32(30-18)22-14-12-20(13-15-22)28(34)35)16-21-17-31(26-11-7-6-10-24(21)26)19(2)29(36)37-23-8-4-3-5-9-23/h3-17,19H,1-2H3,(H,34,35)/b25-16-