[3-(6-methoxynaphthalen-2-yl)-1-phenyl-pyrazol-4-yl]methyl-(phenylmethyl)azanium

Systemtic Name: [3-(6-methoxynaphthalen-2-yl)-1-phenyl-pyrazol-4-yl]methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[3-(6-methoxy-2-naphthyl)-1-phenyl-pyrazol-4-yl]methyl]ammonium CAS Name: [3-(6-methoxy-2-naphthalenyl)-1-phenyl-4-pyrazolyl]methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[3-(6-methoxynaphthalen-2-yl)-1-phenylpyrazol-4-yl]methyl]azanium Traditional Name: benzyl-[[3-(6-methoxy-2-naphthyl)-1-phenyl-pyrazol-4-yl]methyl]ammonium Formula: C28H26N3O+ MolecularWeight: 420.52554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C=C2)C3=NN(C=C3C[NH2+]CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C=C2)C3=NN(C=C3C[NH2+]CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H25N3O/c1-32-27-15-14-22-16-24(13-12-23(22)17-27)28-25(19-29-18-21-8-4-2-5-9-21)20-31(30-28)26-10-6-3-7-11-26/h2-17,20,29H,18-19H2,1H3/p+1