O6-tert-butyl O2-methyl 8-(hydroxymethyl)-4-nitro-7,8-dihydro-3H-pyrrolo[3,2-e]indole-2,6-dicarboxylate

Systemtic Name: O6-tert-butyl O2-methyl 8-(hydroxymethyl)-4-nitro-7,8-dihydro-3H-pyrrolo[3,2-e]indole-2,6-dicarboxylate Openeye Name: O6-tert-butyl O2-methyl 8-(hydroxymethyl)-4-nitro-7,8-dihydro-3H-pyrrolo[3,2-e]indole-2,6-dicarboxylate CAS Name: 8-(hydroxymethyl)-4-nitro-7,8-dihydro-3H-pyrrolo[3,2-e]indole-2,6-dicarboxylic acid O6-tert-butyl ester O2-methyl ester IUPAC Name: 6-O-tert-butyl 2-O-methyl 8-(hydroxymethyl)-4-nitro-7,8-dihydro-3H-pyrrolo[3,2-e]indole-2,6-dicarboxylate Traditional Name: 8-methylol-4-nitro-7,8-dihydro-3H-pyrrol[3,2-e]indole-2,6-dicarboxylic acid O6-tert-butyl ester O2-methyl ester Formula: C18H21N3O7 MolecularWeight: 391.37524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(C2=C3C=C(NC3=C(C=C21)[N+](=O)[O-])C(=O)OC)CO

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(C2=C3C=C(NC3=C(C=C21)[N+](=O)[O-])C(=O)OC)CO

InChI

InChI=1S/C18H21N3O7/c1-18(2,3)28-17(24)20-7-9(8-22)14-10-5-11(16(23)27-4)19-15(10)13(21(25)26)6-12(14)20/h5-6,9,19,22H,7-8H2,1-4H3