1-[2-(2,2-dimethylpropanoylamino)ethanoylamino]ethyl-ethyl-azanium; tetraphenylboranuide

Systemtic Name: 1-[2-(2,2-dimethylpropanoylamino)ethanoylamino]ethyl-ethyl-azanium; tetraphenylboranuide Openeye Name: 1-[[2-(2,2-dimethylpropanoylamino)acetyl]amino]ethyl-ethyl-ammonium; tetraphenylboranuide CAS Name: 1-[[2-[(2,2-dimethyl-1-oxopropyl)amino]-1-oxoethyl]amino]ethyl-ethylammonium; tetraphenylboranuide IUPAC Name: 1-[[2-(2,2-dimethylpropanoylamino)acetyl]amino]ethyl-ethylazanium; tetraphenylboranuide Traditional Name: ethyl-[1-[[2-(pivaloylamino)acetyl]amino]ethyl]ammonium; tetraphenylboranuide Formula: C35H44BN3O2 MolecularWeight: 549.55376

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC[NH2+]C(C)NC(=O)CNC(=O)C(C)(C)C

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC[NH2+]C(C)NC(=O)CNC(=O)C(C)(C)C

InChI

InChI=1S/C24H20B.C11H23N3O2/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-6-12-8(2)14-9(15)7-13-10(16)11(3,4)5/h1-20H;8,12H,6-7H2,1-5H3,(H,13,16)(H,14,15)/q-1;/p+1