1-[(5-azido-2,2-dimethyl-pentyl)amino]-3-(oxidanylideneboranylmethylamino)-4-phenyl-butan-2-ol

Systemtic Name: 1-[(5-azido-2,2-dimethyl-pentyl)amino]-3-(oxidanylideneboranylmethylamino)-4-phenyl-butan-2-ol Openeye Name: 1-[(5-azido-2,2-dimethyl-pentyl)amino]-3-(oxoboranylmethylamino)-4-phenyl-butan-2-ol CAS Name: 1-[(5-azido-2,2-dimethylpentyl)amino]-3-(oxoboranylmethylamino)-4-phenyl-2-butanol IUPAC Name: 1-[(5-azido-2,2-dimethylpentyl)amino]-3-(oxoboranylmethylamino)-4-phenylbutan-2-ol Traditional Name: 1-[(5-azido-2,2-dimethyl-pentyl)amino]-3-(ketoboranylmethylamino)-4-phenyl-butan-2-ol Formula: C18H30BN5O2 MolecularWeight: 359.2741

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Descriptors Computed from Structure

Canonical SMILES:

B(=O)CNC(CC1=CC=CC=C1)C(CNCC(C)(C)CCCN=[N+]=[N-])O

Isomeric SMILES

B(=O)CNC(CC1=CC=CC=C1)C(CNCC(C)(C)CCCN=[N+]=[N-])O

InChI

InChI=1S/C18H30BN5O2/c1-18(2,9-6-10-23-24-20)13-21-12-17(25)16(22-14-19-26)11-15-7-4-3-5-8-15/h3-5,7-8,16-17,21-22,25H,6,9-14H2,1-2H3