[(2S)-2-(dipropylamino)-2-(1-phenylpyrazol-4-yl)ethyl]azanium

Systemtic Name: [(2S)-2-(dipropylamino)-2-(1-phenylpyrazol-4-yl)ethyl]azanium Openeye Name: [(2S)-2-(dipropylamino)-2-(1-phenylpyrazol-4-yl)ethyl]ammonium CAS Name: [(2S)-2-(dipropylamino)-2-(1-phenyl-4-pyrazolyl)ethyl]ammonium IUPAC Name: [(2S)-2-(dipropylamino)-2-(1-phenylpyrazol-4-yl)ethyl]azanium Traditional Name: [(2S)-2-(dipropylamino)-2-(1-phenylpyrazol-4-yl)ethyl]ammonium Formula: C17H27N4+ MolecularWeight: 287.42308

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(C[NH3+])C1=CN(N=C1)C2=CC=CC=C2

Isomeric SMILES

CCCN(CCC)[C@H](C[NH3+])C1=CN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C17H26N4/c1-3-10-20(11-4-2)17(12-18)15-13-19-21(14-15)16-8-6-5-7-9-16/h5-9,13-14,17H,3-4,10-12,18H2,1-2H3/p+1/t17-/m1/s1