ditert-butyl (9Z)-9-oxidanidyl-1,5-diaza-9-azoniacyclododec-9-ene-1,5-dicarboxylate

Systemtic Name: ditert-butyl (9Z)-9-oxidanidyl-1,5-diaza-9-azoniacyclododec-9-ene-1,5-dicarboxylate Openeye Name: ditert-butyl (9Z)-9-oxido-1,5-diaza-9-azoniacyclododec-9-ene-1,5-dicarboxylate CAS Name: (9Z)-9-oxido-1,5-diaza-9-azoniacyclododec-9-ene-1,5-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl (9Z)-9-oxido-1,5-diaza-9-azoniacyclododec-9-ene-1,5-dicarboxylate Traditional Name: (9Z)-9-oxido-1,5-diaza-9-azoniacyclododec-9-ene-1,5-dicarboxylic acid ditert-butyl ester Formula: C19H35N3O5 MolecularWeight: 385.4983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCN(CCC=[N+](CCC1)[O-])C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCN(CC/C=[N+](/CCC1)\[O-])C(=O)OC(C)(C)C

InChI

InChI=1S/C19H35N3O5/c1-18(2,3)26-16(23)20-10-7-11-21(17(24)27-19(4,5)6)13-9-15-22(25)14-8-12-20/h14H,7-13,15H2,1-6H3/b22-14-