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

Systemtic Name: 4-[(4Z)-4-[[1-(1-methoxy-1-oxidanylidene-propan-2-yl)-2-phenyl-indol-3-yl]methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzoic acid Openeye Name: 4-[(4Z)-4-[[1-(2-methoxy-1-methyl-2-oxo-ethyl)-2-phenyl-indol-3-yl]methylene]-3-methyl-5-oxo-pyrazol-1-yl]benzoic acid CAS Name: 4-[(4Z)-4-[[1-(1-methoxy-1-oxopropan-2-yl)-2-phenyl-3-indolyl]methylidene]-3-methyl-5-oxo-1-pyrazolyl]benzoic acid IUPAC Name: 4-[(4Z)-4-[[1-(1-methoxy-1-oxopropan-2-yl)-2-phenylindol-3-yl]methylidene]-3-methyl-5-oxopyrazol-1-yl]benzoic acid Traditional Name: 4-[(4Z)-5-keto-4-[[1-(2-keto-2-methoxy-1-methyl-ethyl)-2-phenyl-indol-3-yl]methylene]-3-methyl-2-pyrazolin-1-yl]benzoic acid Formula: C30H25N3O5 MolecularWeight: 507.5366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=C(N(C3=CC=CC=C32)C(C)C(=O)OC)C4=CC=CC=C4)C5=CC=C(C=C5)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C30H25N3O5/c1-18-24(28(34)33(31-18)22-15-13-21(14-16-22)29(35)36)17-25-23-11-7-8-12-26(23)32(19(2)30(37)38-3)27(25)20-9-5-4-6-10-20/h4-17,19H,1-3H3,(H,35,36)/b24-17-