[1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 2-phenyl-1,2,3-triazole-4-carboxylate

Systemtic Name: [1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 2-phenyl-1,2,3-triazole-4-carboxylate Openeye Name: [2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl] 2-phenyltriazole-4-carboxylate CAS Name: 2-phenyl-4-triazolecarboxylic acid [1-(1H-indol-3-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(1H-indol-3-yl)-1-oxopropan-2-yl] 2-phenyltriazole-4-carboxylate Traditional Name: 2-phenyltriazole-4-carboxylic acid [2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl] ester Formula: C20H16N4O3 MolecularWeight: 360.36604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)OC(=O)C3=NN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)C1=CNC2=CC=CC=C21)OC(=O)C3=NN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H16N4O3/c1-13(19(25)16-11-21-17-10-6-5-9-15(16)17)27-20(26)18-12-22-24(23-18)14-7-3-2-4-8-14/h2-13,21H,1H3