O3-tert-butyl O2-ethyl 6-fluoranyl-4-(phenacylamino)-1H-indole-2,3-dicarboxylate

Systemtic Name: O3-tert-butyl O2-ethyl 6-fluoranyl-4-(phenacylamino)-1H-indole-2,3-dicarboxylate Openeye Name: O3-tert-butyl O2-ethyl 6-fluoro-4-(phenacylamino)-1H-indole-2,3-dicarboxylate CAS Name: 6-fluoro-4-(phenacylamino)-1H-indole-2,3-dicarboxylic acid O3-tert-butyl ester O2-ethyl ester IUPAC Name: 3-O-tert-butyl 2-O-ethyl 6-fluoro-4-(phenacylamino)-1H-indole-2,3-dicarboxylate Traditional Name: 6-fluoro-4-(phenacylamino)-1H-indole-2,3-dicarboxylic acid O3-tert-butyl ester O2-ethyl ester Formula: C24H25FN2O5 MolecularWeight: 440.464103

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=C(C=C2N1)F)NCC(=O)C3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=C(C=C2N1)F)NCC(=O)C3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H25FN2O5/c1-5-31-23(30)21-20(22(29)32-24(2,3)4)19-16(11-15(25)12-17(19)27-21)26-13-18(28)14-9-7-6-8-10-14/h6-12,26-27H,5,13H2,1-4H3