tert-butyl 3-(cyanomethyl)-5-methoxy-indole-1-carboxylate

Systemtic Name: tert-butyl 3-(cyanomethyl)-5-methoxy-indole-1-carboxylate Openeye Name: tert-butyl 3-(cyanomethyl)-5-methoxy-indole-1-carboxylate CAS Name: 3-(cyanomethyl)-5-methoxy-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(cyanomethyl)-5-methoxyindole-1-carboxylate Traditional Name: 3-(cyanomethyl)-5-methoxy-indole-1-carboxylic acid tert-butyl ester Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=C1C=CC(=C2)OC)CC#N

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=C1C=CC(=C2)OC)CC#N

InChI

InChI=1S/C16H18N2O3/c1-16(2,3)21-15(19)18-10-11(7-8-17)13-9-12(20-4)5-6-14(13)18/h5-6,9-10H,7H2,1-4H3