tert-butyl 3-(2-isocyanatoethanoyl)indole-1-carboxylate

Systemtic Name: tert-butyl 3-(2-isocyanatoethanoyl)indole-1-carboxylate Openeye Name: tert-butyl 3-(2-isocyanatoacetyl)indole-1-carboxylate CAS Name: 3-(2-isocyanato-1-oxoethyl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-isocyanatoacetyl)indole-1-carboxylate Traditional Name: 3-(2-isocyanatoacetyl)indole-1-carboxylic acid tert-butyl ester Formula: C16H16N2O4 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C(=O)CN=C=O

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C(=O)CN=C=O

InChI

InChI=1S/C16H16N2O4/c1-16(2,3)22-15(21)18-9-12(14(20)8-17-10-19)11-6-4-5-7-13(11)18/h4-7,9H,8H2,1-3H3