[2-[(5-benzamido-6-methoxy-6-oxidanyl-hexyl)amino]-2-oxidanylidene-ethyl]carbamoylboron

Systemtic Name: [2-[(5-benzamido-6-methoxy-6-oxidanyl-hexyl)amino]-2-oxidanylidene-ethyl]carbamoylboron Openeye Name: [2-[(5-benzamido-6-hydroxy-6-methoxy-hexyl)amino]-2-oxo-ethyl]carbamoylboron CAS Name: [[[2-[(5-benzamido-6-hydroxy-6-methoxyhexyl)amino]-2-oxoethyl]amino]-oxomethyl]boron IUPAC Name: [2-[(5-benzamido-6-hydroxy-6-methoxyhexyl)amino]-2-oxoethyl]carbamoylboron Traditional Name: [2-[(5-benzamido-6-hydroxy-6-methoxy-hexyl)amino]-2-keto-ethyl]carbamoylboron Formula: C17H24BN3O5 MolecularWeight: 361.20056

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Descriptors Computed from Structure

Canonical SMILES:

[B]C(=O)NCC(=O)NCCCCC(C(O)OC)NC(=O)C1=CC=CC=C1

Isomeric SMILES

[B]C(=O)NCC(=O)NCCCCC(C(O)OC)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C17H24BN3O5/c1-26-16(24)13(21-15(23)12-7-3-2-4-8-12)9-5-6-10-19-14(22)11-20-17(18)25/h2-4,7-8,13,16,24H,5-6,9-11H2,1H3,(H,19,22)(H,20,25)(H,21,23)