tert-butyl 7-[(6-cyano-1H-indol-3-yl)carbonylamino]heptanoate

Systemtic Name: tert-butyl 7-[(6-cyano-1H-indol-3-yl)carbonylamino]heptanoate Openeye Name: tert-butyl 7-[(6-cyano-1H-indole-3-carbonyl)amino]heptanoate CAS Name: 7-[[(6-cyano-1H-indol-3-yl)-oxomethyl]amino]heptanoic acid tert-butyl ester IUPAC Name: tert-butyl 7-[(6-cyano-1H-indole-3-carbonyl)amino]heptanoate Traditional Name: 7-[(6-cyano-1H-indole-3-carbonyl)amino]enanthic acid tert-butyl ester Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCCCCCNC(=O)C1=CNC2=C1C=CC(=C2)C#N

Isomeric SMILES

CC(C)(C)OC(=O)CCCCCCNC(=O)C1=CNC2=C1C=CC(=C2)C#N

InChI

InChI=1S/C21H27N3O3/c1-21(2,3)27-19(25)8-6-4-5-7-11-23-20(26)17-14-24-18-12-15(13-22)9-10-16(17)18/h9-10,12,14,24H,4-8,11H2,1-3H3,(H,23,26)