[(2R)-2-(azepan-1-yl)-2-(1-phenylpyrazol-4-yl)ethyl]azanium

Systemtic Name: [(2R)-2-(azepan-1-yl)-2-(1-phenylpyrazol-4-yl)ethyl]azanium Openeye Name: [(2R)-2-(azepan-1-yl)-2-(1-phenylpyrazol-4-yl)ethyl]ammonium CAS Name: [(2R)-2-(1-azepanyl)-2-(1-phenyl-4-pyrazolyl)ethyl]ammonium IUPAC Name: [(2R)-2-(azepan-1-yl)-2-(1-phenylpyrazol-4-yl)ethyl]azanium Traditional Name: [(2R)-2-(azepan-1-yl)-2-(1-phenylpyrazol-4-yl)ethyl]ammonium Formula: C17H25N4+ MolecularWeight: 285.4072

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(C[NH3+])C2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)[C@@H](C[NH3+])C2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H24N4/c18-12-17(20-10-6-1-2-7-11-20)15-13-19-21(14-15)16-8-4-3-5-9-16/h3-5,8-9,13-14,17H,1-2,6-7,10-12,18H2/p+1/t17-/m0/s1