O2-tert-butyl O4-ethyl 3-ethyl-5-[(1H-indol-6-ylamino)methyl]-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-tert-butyl O4-ethyl 3-ethyl-5-[(1H-indol-6-ylamino)methyl]-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-tert-butyl O4-ethyl 3-ethyl-5-[(1H-indol-6-ylamino)methyl]-1H-pyrrole-2,4-dicarboxylate CAS Name: 3-ethyl-5-[(1H-indol-6-ylamino)methyl]-1H-pyrrole-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester IUPAC Name: 2-O-tert-butyl 4-O-ethyl 3-ethyl-5-[(1H-indol-6-ylamino)methyl]-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3-ethyl-5-[(1H-indol-6-ylamino)methyl]-1H-pyrrole-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester Formula: C23H29N3O4 MolecularWeight: 411.49406

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C(=O)OCC)CNC2=CC3=C(C=C2)C=CN3)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=C(NC(=C1C(=O)OCC)CNC2=CC3=C(C=C2)C=CN3)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H29N3O4/c1-6-16-19(21(27)29-7-2)18(26-20(16)22(28)30-23(3,4)5)13-25-15-9-8-14-10-11-24-17(14)12-15/h8-12,24-26H,6-7,13H2,1-5H3