[2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] 1-methylpyrazole-4-carboxylate

Systemtic Name: [2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] 1-methylpyrazole-4-carboxylate Openeye Name: [2-(1H-indol-3-yl)-2-oxo-1-phenyl-ethyl] 1-methylpyrazole-4-carboxylate CAS Name: 1-methyl-4-pyrazolecarboxylic acid [2-(1H-indol-3-yl)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(1H-indol-3-yl)-2-oxo-1-phenylethyl] 1-methylpyrazole-4-carboxylate Traditional Name: 1-methylpyrazole-4-carboxylic acid [2-(1H-indol-3-yl)-2-keto-1-phenyl-ethyl] ester Formula: C21H17N3O3 MolecularWeight: 359.37798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)OC(C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

CN1C=C(C=N1)C(=O)OC(C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H17N3O3/c1-24-13-15(11-23-24)21(26)27-20(14-7-3-2-4-8-14)19(25)17-12-22-18-10-6-5-9-16(17)18/h2-13,20,22H,1H3