O1-tert-butyl O2-methyl 6-chloranyl-3-(phenacylamino)indole-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-methyl 6-chloranyl-3-(phenacylamino)indole-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-methyl 6-chloro-3-(phenacylamino)indole-1,2-dicarboxylate CAS Name: 6-chloro-3-(phenacylamino)indole-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester IUPAC Name: 1-O-tert-butyl 2-O-methyl 6-chloro-3-(phenacylamino)indole-1,2-dicarboxylate Traditional Name: 6-chloro-3-(phenacylamino)indole-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester Formula: C23H23ClN2O5 MolecularWeight: 442.89212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C=CC(=C2)Cl)C(=C1C(=O)OC)NCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C=CC(=C2)Cl)C(=C1C(=O)OC)NCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H23ClN2O5/c1-23(2,3)31-22(29)26-17-12-15(24)10-11-16(17)19(20(26)21(28)30-4)25-13-18(27)14-8-6-5-7-9-14/h5-12,25H,13H2,1-4H3