(4-dimethylaminophenyl)methyl-[(1S)-1-(1-ethyl-5-methyl-pyrazol-4-yl)ethyl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-[(1S)-1-(1-ethyl-5-methyl-pyrazol-4-yl)ethyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-[(1S)-1-(1-ethyl-5-methyl-pyrazol-4-yl)ethyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-[(1S)-1-(1-ethyl-5-methyl-4-pyrazolyl)ethyl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-[(1S)-1-(1-ethyl-5-methylpyrazol-4-yl)ethyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-[(1S)-1-(1-ethyl-5-methyl-pyrazol-4-yl)ethyl]ammonium Formula: C17H27N4+ MolecularWeight: 287.42308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCN1C(=C(C=N1)[C@H](C)[NH2+]CC2=CC=C(C=C2)N(C)C)C

InChI

InChI=1S/C17H26N4/c1-6-21-14(3)17(12-19-21)13(2)18-11-15-7-9-16(10-8-15)20(4)5/h7-10,12-13,18H,6,11H2,1-5H3/p+1/t13-/m0/s1