[(3E)-2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] 5-propan-2-yl-1H-pyrazole-4-carboxylate

Systemtic Name: [(3E)-2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] 5-propan-2-yl-1H-pyrazole-4-carboxylate Openeye Name: [(3E)-2-oxo-3-(1,3,3-trimethylindolin-2-ylidene)propyl] 5-isopropyl-1H-pyrazole-4-carboxylate CAS Name: 5-propan-2-yl-1H-pyrazole-4-carboxylic acid [(3E)-2-oxo-3-(1,3,3-trimethyl-2-indolylidene)propyl] ester IUPAC Name: [(3E)-2-oxo-3-(1,3,3-trimethylindol-2-ylidene)propyl] 5-propan-2-yl-1H-pyrazole-4-carboxylate Traditional Name: 5-isopropyl-1H-pyrazole-4-carboxylic acid [(3E)-2-keto-3-(1,3,3-trimethylindolin-2-ylidene)propyl] ester Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=NN1)C(=O)OCC(=O)C=C2C(C3=CC=CC=C3N2C)(C)C

Isomeric SMILES

CC(C)C1=C(C=NN1)C(=O)OCC(=O)/C=C/2\C(C3=CC=CC=C3N2C)(C)C

InChI

InChI=1S/C21H25N3O3/c1-13(2)19-15(11-22-23-19)20(26)27-12-14(25)10-18-21(3,4)16-8-6-7-9-17(16)24(18)5/h6-11,13H,12H2,1-5H3,(H,22,23)/b18-10+