tert-butyl 3-(cyanomethyl)indole-1-carboxylate

Systemtic Name: tert-butyl 3-(cyanomethyl)indole-1-carboxylate Openeye Name: tert-butyl 3-(cyanomethyl)indole-1-carboxylate CAS Name: 3-(cyanomethyl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(cyanomethyl)indole-1-carboxylate Traditional Name: 3-(cyanomethyl)indole-1-carboxylic acid tert-butyl ester Formula: C15H16N2O2 MolecularWeight: 256.29974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)CC#N

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)CC#N

InChI

InChI=1S/C15H16N2O2/c1-15(2,3)19-14(18)17-10-11(8-9-16)12-6-4-5-7-13(12)17/h4-7,10H,8H2,1-3H3