tert-butyl 5-bromanyl-3-[(2E)-3-ethoxy-2-methoxyimino-3-oxidanylidene-propyl]indole-1-carboxylate

Systemtic Name: tert-butyl 5-bromanyl-3-[(2E)-3-ethoxy-2-methoxyimino-3-oxidanylidene-propyl]indole-1-carboxylate Openeye Name: tert-butyl 5-bromo-3-[(2E)-3-ethoxy-2-methoxyimino-3-oxo-propyl]indole-1-carboxylate CAS Name: 5-bromo-3-[(2E)-3-ethoxy-2-methoxyimino-3-oxopropyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-bromo-3-[(2E)-3-ethoxy-2-methoxyimino-3-oxopropyl]indole-1-carboxylate Traditional Name: 5-bromo-3-[(2E)-3-ethoxy-3-keto-2-methyloximino-propyl]indole-1-carboxylic acid tert-butyl ester Formula: C19H23BrN2O5 MolecularWeight: 439.30032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=NOC)CC1=CN(C2=C1C=C(C=C2)Br)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)/C(=N/OC)/CC1=CN(C2=C1C=C(C=C2)Br)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H23BrN2O5/c1-6-26-17(23)15(21-25-5)9-12-11-22(18(24)27-19(2,3)4)16-8-7-13(20)10-14(12)16/h7-8,10-11H,6,9H2,1-5H3/b21-15+