tert-butyl 3-[(6-nitroindazol-1-yl)methyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(6-nitroindazol-1-yl)methyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-[(6-nitroindazol-1-yl)methyl]pyrrolidine-1-carboxylate CAS Name: 3-[(6-nitro-1-indazolyl)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(6-nitroindazol-1-yl)methyl]pyrrolidine-1-carboxylate Traditional Name: 3-[(6-nitroindazol-1-yl)methyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)CN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C1)CN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2

InChI

InChI=1S/C17H22N4O4/c1-17(2,3)25-16(22)19-7-6-12(10-19)11-20-15-8-14(21(23)24)5-4-13(15)9-18-20/h4-5,8-9,12H,6-7,10-11H2,1-3H3