bis(3-chloranyl-4-methyl-phenyl)boranyl 2,5-bis(azanyl)-5-oxidanylidene-pentanoate

Systemtic Name: bis(3-chloranyl-4-methyl-phenyl)boranyl 2,5-bis(azanyl)-5-oxidanylidene-pentanoate Openeye Name: bis(3-chloro-4-methyl-phenyl)boranyl 2,5-diamino-5-oxo-pentanoate CAS Name: 2,5-diamino-5-oxopentanoic acid bis(3-chloro-4-methylphenyl)boranyl ester IUPAC Name: bis(3-chloro-4-methylphenyl)boranyl 2,5-diamino-5-oxopentanoate Traditional Name: 2,5-diamino-5-keto-valeric acid bis(3-chloro-4-methyl-phenyl)boranyl ester Formula: C19H21BCl2N2O3 MolecularWeight: 407.09864

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=C(C=C1)C)Cl)(C2=CC(=C(C=C2)C)Cl)OC(=O)C(CCC(=O)N)N

Isomeric SMILES

B(C1=CC(=C(C=C1)C)Cl)(C2=CC(=C(C=C2)C)Cl)OC(=O)C(CCC(=O)N)N

InChI

InChI=1S/C19H21BCl2N2O3/c1-11-3-5-13(9-15(11)21)20(14-6-4-12(2)16(22)10-14)27-19(26)17(23)7-8-18(24)25/h3-6,9-10,17H,7-8,23H2,1-2H3,(H2,24,25)