[(1S)-1-[1-(3-chloranyl-4-methyl-phenyl)-5-methyl-pyrazol-4-yl]ethyl]azanium

Systemtic Name: [(1S)-1-[1-(3-chloranyl-4-methyl-phenyl)-5-methyl-pyrazol-4-yl]ethyl]azanium Openeye Name: [(1S)-1-[1-(3-chloro-4-methyl-phenyl)-5-methyl-pyrazol-4-yl]ethyl]ammonium CAS Name: [(1S)-1-[1-(3-chloro-4-methylphenyl)-5-methyl-4-pyrazolyl]ethyl]ammonium IUPAC Name: [(1S)-1-[1-(3-chloro-4-methylphenyl)-5-methylpyrazol-4-yl]ethyl]azanium Traditional Name: [(1S)-1-[1-(3-chloro-4-methyl-phenyl)-5-methyl-pyrazol-4-yl]ethyl]ammonium Formula: C13H17ClN3+ MolecularWeight: 250.74718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C=N2)C(C)[NH3+])C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C(C=N2)[C@H](C)[NH3+])C)Cl

InChI

InChI=1S/C13H16ClN3/c1-8-4-5-11(6-13(8)14)17-10(3)12(7-16-17)9(2)15/h4-7,9H,15H2,1-3H3/p+1/t9-/m0/s1