[5-(2-methoxy-2-oxidanylidene-ethyl)-4-oxidanylidene-2,3-dihydro-1H-1,5-benzodiazepin-3-yl]carbamoylboron

Systemtic Name: [5-(2-methoxy-2-oxidanylidene-ethyl)-4-oxidanylidene-2,3-dihydro-1H-1,5-benzodiazepin-3-yl]carbamoylboron Openeye Name: [5-(2-methoxy-2-oxo-ethyl)-4-oxo-2,3-dihydro-1H-1,5-benzodiazepin-3-yl]carbamoylboron CAS Name: [[[5-(2-methoxy-2-oxoethyl)-4-oxo-2,3-dihydro-1H-1,5-benzodiazepin-3-yl]amino]-oxomethyl]boron IUPAC Name: [5-(2-methoxy-2-oxoethyl)-4-oxo-2,3-dihydro-1H-1,5-benzodiazepin-3-yl]carbamoylboron Traditional Name: [4-keto-5-(2-keto-2-methoxy-ethyl)-2,3-dihydro-1H-1,5-benzodiazepin-3-yl]carbamoylboron Formula: C13H14BN3O4 MolecularWeight: 287.07896

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Descriptors Computed from Structure

Canonical SMILES:

[B]C(=O)NC1CNC2=CC=CC=C2N(C1=O)CC(=O)OC

Isomeric SMILES

[B]C(=O)NC1CNC2=CC=CC=C2N(C1=O)CC(=O)OC

InChI

InChI=1S/C13H14BN3O4/c1-21-11(18)7-17-10-5-3-2-4-8(10)15-6-9(12(17)19)16-13(14)20/h2-5,9,15H,6-7H2,1H3,(H,16,20)