methyl 2,2-dicyclohexyl-3,5-dimethyl-4-prop-2-enyl-1-oxa-4-azonia-2-boranuidacyclopent-4-ene-3-carboxylate

Systemtic Name: methyl 2,2-dicyclohexyl-3,5-dimethyl-4-prop-2-enyl-1-oxa-4-azonia-2-boranuidacyclopent-4-ene-3-carboxylate Openeye Name: methyl 4-allyl-2,2-dicyclohexyl-3,5-dimethyl-1-oxa-4-azonia-2-boranuidacyclopent-4-ene-3-carboxylate CAS Name: 2,2-dicyclohexyl-3,5-dimethyl-4-prop-2-enyl-1-oxa-4-azonia-2-boranuidacyclopent-4-ene-3-carboxylic acid methyl ester IUPAC Name: methyl 2,2-dicyclohexyl-3,5-dimethyl-4-prop-2-enyl-1-oxa-4-azonia-2-boranuidacyclopent-4-ene-3-carboxylate Traditional Name: 4-allyl-2,2-dicyclohexyl-3,5-dimethyl-1-oxa-4-azonia-2-boranuidacyclopent-4-ene-3-carboxylic acid methyl ester Formula: C21H36BNO3 MolecularWeight: 361.32644

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Descriptors Computed from Structure

Canonical SMILES:

[B-]1(C([N+](=C(O1)C)CC=C)(C)C(=O)OC)(C2CCCCC2)C3CCCCC3

Isomeric SMILES

[B-]1(C([N+](=C(O1)C)CC=C)(C)C(=O)OC)(C2CCCCC2)C3CCCCC3

InChI

InChI=1S/C21H36BNO3/c1-5-16-23-17(2)26-22(18-12-8-6-9-13-18,19-14-10-7-11-15-19)21(23,3)20(24)25-4/h5,18-19H,1,6-16H2,2-4H3