tert-butyl 3-[(E)-C-(2-methylprop-2-enyl)-N-oxidanyl-carbonimidoyl]indole-1-carboxylate

Systemtic Name: tert-butyl 3-[(E)-C-(2-methylprop-2-enyl)-N-oxidanyl-carbonimidoyl]indole-1-carboxylate Openeye Name: tert-butyl 3-[(E)-N-hydroxy-C-(2-methylallyl)carbonimidoyl]indole-1-carboxylate CAS Name: 3-[(1E)-1-hydroxyimino-3-methylbut-3-enyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(E)-N-hydroxy-C-(2-methylprop-2-enyl)carbonimidoyl]indole-1-carboxylate Traditional Name: 3-(3-methylbut-3-enehydroximoyl)indole-1-carboxylic acid tert-butyl ester Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CC(=NO)C1=CN(C2=CC=CC=C21)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=C)C/C(=N\O)/C1=CN(C2=CC=CC=C21)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H22N2O3/c1-12(2)10-15(19-22)14-11-20(17(21)23-18(3,4)5)16-9-7-6-8-13(14)16/h6-9,11,22H,1,10H2,2-5H3/b19-15+