[(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]-(4-propan-2-ylphenyl)azanium

Systemtic Name: [(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]-(4-propan-2-ylphenyl)azanium Openeye Name: [(1R)-2-(azepan-1-yl)-1-methyl-2-oxo-ethyl]-(4-isopropylphenyl)ammonium CAS Name: [(2R)-1-(1-azepanyl)-1-oxopropan-2-yl]-(4-propan-2-ylphenyl)ammonium IUPAC Name: [(2R)-1-(azepan-1-yl)-1-oxopropan-2-yl]-(4-propan-2-ylphenyl)azanium Traditional Name: [(1R)-2-(azepan-1-yl)-2-keto-1-methyl-ethyl]-p-cumenyl-ammonium Formula: C18H29N2O+ MolecularWeight: 289.43566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)[NH2+]C(C)C(=O)N2CCCCCC2

Isomeric SMILES

C[C@H](C(=O)N1CCCCCC1)[NH2+]C2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C18H28N2O/c1-14(2)16-8-10-17(11-9-16)19-15(3)18(21)20-12-6-4-5-7-13-20/h8-11,14-15,19H,4-7,12-13H2,1-3H3/p+1/t15-/m1/s1