1,3-benzoxazol-2-ylmethyl-[(1,3-diphenylpyrazol-4-yl)methyl]-methyl-azanium

Systemtic Name: 1,3-benzoxazol-2-ylmethyl-[(1,3-diphenylpyrazol-4-yl)methyl]-methyl-azanium Openeye Name: 1,3-benzoxazol-2-ylmethyl-[(1,3-diphenylpyrazol-4-yl)methyl]-methyl-ammonium CAS Name: 1,3-benzoxazol-2-ylmethyl-[(1,3-diphenyl-4-pyrazolyl)methyl]-methylammonium IUPAC Name: 1,3-benzoxazol-2-ylmethyl-[(1,3-diphenylpyrazol-4-yl)methyl]-methylazanium Traditional Name: 1,3-benzoxazol-2-ylmethyl-[(1,3-diphenylpyrazol-4-yl)methyl]-methyl-ammonium Formula: C25H23N4O+ MolecularWeight: 395.47632

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)CC4=NC5=CC=CC=C5O4

Isomeric SMILES

C[NH+](CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)CC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C25H22N4O/c1-28(18-24-26-22-14-8-9-15-23(22)30-24)16-20-17-29(21-12-6-3-7-13-21)27-25(20)19-10-4-2-5-11-19/h2-15,17H,16,18H2,1H3/p+1