2-[[4-[[5-(2-ethoxy-2-oxidanylidene-ethoxy)-1-methyl-3-propyl-pyrazol-4-yl]methyl]phenyl]carbamoyl]benzoic acid

Systemtic Name: 2-[[4-[[5-(2-ethoxy-2-oxidanylidene-ethoxy)-1-methyl-3-propyl-pyrazol-4-yl]methyl]phenyl]carbamoyl]benzoic acid Openeye Name: 2-[[4-[[5-(2-ethoxy-2-oxo-ethoxy)-1-methyl-3-propyl-pyrazol-4-yl]methyl]phenyl]carbamoyl]benzoic acid CAS Name: 2-[[4-[[5-(2-ethoxy-2-oxoethoxy)-1-methyl-3-propyl-4-pyrazolyl]methyl]anilino]-oxomethyl]benzoic acid IUPAC Name: 2-[[4-[[5-(2-ethoxy-2-oxoethoxy)-1-methyl-3-propylpyrazol-4-yl]methyl]phenyl]carbamoyl]benzoic acid Traditional Name: 2-[[4-[[5-(2-ethoxy-2-keto-ethoxy)-1-methyl-3-propyl-pyrazol-4-yl]methyl]phenyl]carbamoyl]benzoic acid Formula: C26H29N3O6 MolecularWeight: 479.52496

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1CC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C(=O)O)OCC(=O)OCC)C

Isomeric SMILES

CCCC1=NN(C(=C1CC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C(=O)O)OCC(=O)OCC)C

InChI

InChI=1S/C26H29N3O6/c1-4-8-22-21(25(29(3)28-22)35-16-23(30)34-5-2)15-17-11-13-18(14-12-17)27-24(31)19-9-6-7-10-20(19)26(32)33/h6-7,9-14H,4-5,8,15-16H2,1-3H3,(H,27,31)(H,32,33)