(1-ethylpyrazol-3-yl)methyl-[[3-methoxy-4-(2-methylpropoxy)phenyl]methyl]azanium

Systemtic Name: (1-ethylpyrazol-3-yl)methyl-[[3-methoxy-4-(2-methylpropoxy)phenyl]methyl]azanium Openeye Name: (1-ethylpyrazol-3-yl)methyl-[(4-isobutoxy-3-methoxy-phenyl)methyl]ammonium CAS Name: (1-ethyl-3-pyrazolyl)methyl-[[3-methoxy-4-(2-methylpropoxy)phenyl]methyl]ammonium IUPAC Name: (1-ethylpyrazol-3-yl)methyl-[[3-methoxy-4-(2-methylpropoxy)phenyl]methyl]azanium Traditional Name: (1-ethylpyrazol-3-yl)methyl-(4-isobutoxy-3-methoxy-benzyl)ammonium Formula: C18H28N3O2+ MolecularWeight: 318.43382

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC(=N1)C[NH2+]CC2=CC(=C(C=C2)OCC(C)C)OC

Isomeric SMILES

CCN1C=CC(=N1)C[NH2+]CC2=CC(=C(C=C2)OCC(C)C)OC

InChI

InChI=1S/C18H27N3O2/c1-5-21-9-8-16(20-21)12-19-11-15-6-7-17(18(10-15)22-4)23-13-14(2)3/h6-10,14,19H,5,11-13H2,1-4H3/p+1