cyclooctyl-[(2S)-1-[(2,5-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: cyclooctyl-[(2S)-1-[(2,5-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: cyclooctyl-[(1S)-2-(2,5-dimethylanilino)-1-methyl-2-oxo-ethyl]ammonium CAS Name: cyclooctyl-[(2S)-1-(2,5-dimethylanilino)-1-oxopropan-2-yl]ammonium IUPAC Name: cyclooctyl-[(2S)-1-(2,5-dimethylanilino)-1-oxopropan-2-yl]azanium Traditional Name: cyclooctyl-[(1S)-2-(2,5-dimethylanilino)-2-keto-1-methyl-ethyl]ammonium Formula: C19H31N2O+ MolecularWeight: 303.46224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30N2O/c1-14-11-12-15(2)18(13-14)21-19(22)16(3)20-17-9-7-5-4-6-8-10-17/h11-13,16-17,20H,4-10H2,1-3H3,(H,21,22)/p+1/t16-/m0/s1