2-[(3,4-dimethoxyphenyl)-(3-methylbutanoyl)amino]ethylazanium

Systemtic Name: 2-[(3,4-dimethoxyphenyl)-(3-methylbutanoyl)amino]ethylazanium Openeye Name: 2-[3,4-dimethoxy-N-(3-methylbutanoyl)anilino]ethylammonium CAS Name: 2-(3,4-dimethoxy-N-(3-methyl-1-oxobutyl)anilino)ethylammonium IUPAC Name: 2-[3,4-dimethoxy-N-(3-methylbutanoyl)anilino]ethylazanium Traditional Name: 2-(N-isovaleryl-3,4-dimethoxy-anilino)ethylammonium Formula: C15H25N2O3+ MolecularWeight: 281.3706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N(CC[NH3+])C1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CC(C)CC(=O)N(CC[NH3+])C1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C15H24N2O3/c1-11(2)9-15(18)17(8-7-16)12-5-6-13(19-3)14(10-12)20-4/h5-6,10-11H,7-9,16H2,1-4H3/p+1