tert-butyl (3E)-3-(1H-indol-3-ylmethylidene)-2-oxidanylidene-indole-1-carboxylate

Systemtic Name: tert-butyl (3E)-3-(1H-indol-3-ylmethylidene)-2-oxidanylidene-indole-1-carboxylate Openeye Name: tert-butyl (3E)-3-(1H-indol-3-ylmethylene)-2-oxo-indoline-1-carboxylate CAS Name: (3E)-3-(1H-indol-3-ylmethylidene)-2-oxo-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3E)-3-(1H-indol-3-ylmethylidene)-2-oxoindole-1-carboxylate Traditional Name: (3E)-3-(1H-indol-3-ylmethylene)-2-keto-indoline-1-carboxylic acid tert-butyl ester Formula: C22H20N2O3 MolecularWeight: 360.4058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=CC=CC=C2C(=CC3=CNC4=CC=CC=C43)C1=O

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=CC=CC=C2/C(=C\C3=CNC4=CC=CC=C43)/C1=O

InChI

InChI=1S/C22H20N2O3/c1-22(2,3)27-21(26)24-19-11-7-5-9-16(19)17(20(24)25)12-14-13-23-18-10-6-4-8-15(14)18/h4-13,23H,1-3H3/b17-12+