[3-[[4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]methylazaniumyl]-2,2-dimethyl-propyl]-dimethyl-azanium

Systemtic Name: [3-[[4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]methylazaniumyl]-2,2-dimethyl-propyl]-dimethyl-azanium Openeye Name: [3-[[4-(2-amino-2-oxo-ethoxy)phenyl]methylammonio]-2,2-dimethyl-propyl]-dimethyl-ammonium CAS Name: [3-[[4-(2-amino-2-oxoethoxy)phenyl]methylammonio]-2,2-dimethylpropyl]-dimethylammonium IUPAC Name: [3-[[4-(2-amino-2-oxoethoxy)phenyl]methylazaniumyl]-2,2-dimethylpropyl]-dimethylazanium Traditional Name: [3-[[4-(2-amino-2-keto-ethoxy)benzyl]ammonio]-2,2-dimethyl-propyl]-dimethyl-ammonium Formula: C16H29N3O2+2 MolecularWeight: 295.42036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH2+]CC1=CC=C(C=C1)OCC(=O)N)C[NH+](C)C

Isomeric SMILES

CC(C)(C[NH2+]CC1=CC=C(C=C1)OCC(=O)N)C[NH+](C)C

InChI

InChI=1S/C16H27N3O2/c1-16(2,12-19(3)4)11-18-9-13-5-7-14(8-6-13)21-10-15(17)20/h5-8,18H,9-12H2,1-4H3,(H2,17,20)/p+2