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phenethyl-(phenylmethyl)-[(5-phenyl-1H-pyrazol-4-yl)methyl]azanium

phenethyl-(phenylmethyl)-[(5-phenyl-1H-pyrazol-4-yl)methyl]azanium

Systemtic Name:phenethyl-(phenylmethyl)-[(5-phenyl-1H-pyrazol-4-yl)methyl]azanium
Openeye Name:benzyl-phenethyl-[(5-phenyl-1H-pyrazol-4-yl)methyl]ammonium
CAS Name:phenethyl-(phenylmethyl)-[(5-phenyl-1H-pyrazol-4-yl)methyl]ammonium
IUPAC Name:benzyl-phenethyl-[(5-phenyl-1H-pyrazol-4-yl)methyl]azanium
Traditional Name:benzyl-phenethyl-[(5-phenyl-1H-pyrazol-4-yl)methyl]ammonium
Formula: C25H26N3+
MolecularWeight: 368.49404
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC[NH+](CC2=CC=CC=C2)CC3=C(NN=C3)C4=CC=CC=C4


Isomeric SMILES

C1=CC=C(C=C1)CC[NH+](CC2=CC=CC=C2)CC3=C(NN=C3)C4=CC=CC=C4


InChI

InChI=1S/C25H25N3/c1-4-10-21(11-5-1)16-17-28(19-22-12-6-2-7-13-22)20-24-18-26-27-25(24)23-14-8-3-9-15-23/h1-15,18H,16-17,19-20H2,(H,26,27)/p+1


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