ditert-butyl 1-[2,6-bis(azanyl)hexanoyl]pyrrolidin-1-ium-1,2-dicarboxylate

Systemtic Name: ditert-butyl 1-[2,6-bis(azanyl)hexanoyl]pyrrolidin-1-ium-1,2-dicarboxylate Openeye Name: ditert-butyl 1-(2,6-diaminohexanoyl)pyrrolidin-1-ium-1,2-dicarboxylate CAS Name: 1-(2,6-diamino-1-oxohexyl)pyrrolidin-1-ium-1,2-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 1-(2,6-diaminohexanoyl)pyrrolidin-1-ium-1,2-dicarboxylate Traditional Name: 1-(2,6-diaminohexanoyl)pyrrolidin-1-ium-1,2-dicarboxylic acid ditert-butyl ester Formula: C20H38N3O5+ MolecularWeight: 400.53282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCC[N+]1(C(=O)C(CCCCN)N)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C1CCC[N+]1(C(=O)C(CCCCN)N)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H38N3O5/c1-19(2,3)27-17(25)15-11-9-13-23(15,18(26)28-20(4,5)6)16(24)14(22)10-7-8-12-21/h14-15H,7-13,21-22H2,1-6H3/q+1