3-[(3,4-dimethoxyphenyl)-(2-methylpropanoyl)amino]propylazanium

Systemtic Name: 3-[(3,4-dimethoxyphenyl)-(2-methylpropanoyl)amino]propylazanium Openeye Name: 3-[3,4-dimethoxy-N-(2-methylpropanoyl)anilino]propylammonium CAS Name: 3-(3,4-dimethoxy-N-(2-methyl-1-oxopropyl)anilino)propylammonium IUPAC Name: 3-[3,4-dimethoxy-N-(2-methylpropanoyl)anilino]propylazanium Traditional Name: 3-(N-isobutyryl-3,4-dimethoxy-anilino)propylammonium Formula: C15H25N2O3+ MolecularWeight: 281.3706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N2O3/c1-11(2)15(18)17(9-5-8-16)12-6-7-13(19-3)14(10-12)20-4/h6-7,10-11H,5,8-9,16H2,1-4H3/p+1