(2-azanyl-2-oxidanylidene-ethyl)-[3-(3,5-dimethylphenoxy)propyl]-propan-2-yl-azanium

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl)-[3-(3,5-dimethylphenoxy)propyl]-propan-2-yl-azanium Openeye Name: (2-amino-2-oxo-ethyl)-[3-(3,5-dimethylphenoxy)propyl]-isopropyl-ammonium CAS Name: (2-amino-2-oxoethyl)-[3-(3,5-dimethylphenoxy)propyl]-propan-2-ylammonium IUPAC Name: (2-amino-2-oxoethyl)-[3-(3,5-dimethylphenoxy)propyl]-propan-2-ylazanium Traditional Name: (2-amino-2-keto-ethyl)-[3-(3,5-dimethylphenoxy)propyl]-isopropyl-ammonium Formula: C16H27N2O2+ MolecularWeight: 279.39778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O2/c1-12(2)18(11-16(17)19)6-5-7-20-15-9-13(3)8-14(4)10-15/h8-10,12H,5-7,11H2,1-4H3,(H2,17,19)/p+1