cyclooctyl-[2-oxidanylidene-2-[[(2S)-3-oxidanylidene-1-phenyl-butan-2-yl]amino]ethyl]azanium

Systemtic Name: cyclooctyl-[2-oxidanylidene-2-[[(2S)-3-oxidanylidene-1-phenyl-butan-2-yl]amino]ethyl]azanium Openeye Name: [2-[[(1S)-1-benzyl-2-oxo-propyl]amino]-2-oxo-ethyl]-cyclooctyl-ammonium CAS Name: cyclooctyl-[2-oxo-2-[[(2S)-3-oxo-1-phenylbutan-2-yl]amino]ethyl]ammonium IUPAC Name: cyclooctyl-[2-oxo-2-[[(2S)-3-oxo-1-phenylbutan-2-yl]amino]ethyl]azanium Traditional Name: [2-[[(1S)-1-benzyl-2-keto-propyl]amino]-2-keto-ethyl]-cyclooctyl-ammonium Formula: C20H31N2O2+ MolecularWeight: 331.47234

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=CC=C1)NC(=O)C[NH2+]C2CCCCCCC2

Isomeric SMILES

CC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C[NH2+]C2CCCCCCC2

InChI

InChI=1S/C20H30N2O2/c1-16(23)19(14-17-10-6-5-7-11-17)22-20(24)15-21-18-12-8-3-2-4-9-13-18/h5-7,10-11,18-19,21H,2-4,8-9,12-15H2,1H3,(H,22,24)/p+1/t19-/m0/s1