(1,3-diphenylpyrazol-4-yl)methyl-[2-[(2-methoxy-2-oxidanylidene-ethyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl-[2-[(2-methoxy-2-oxidanylidene-ethyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl-[2-[(2-methoxy-2-oxo-ethyl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (1,3-diphenyl-4-pyrazolyl)methyl-[2-[(2-methoxy-2-oxoethyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl-[2-[(2-methoxy-2-oxoethyl)amino]-2-oxoethyl]-methylazanium Traditional Name: (1,3-diphenylpyrazol-4-yl)methyl-[2-keto-2-[(2-keto-2-methoxy-ethyl)amino]ethyl]-methyl-ammonium Formula: C22H25N4O3+ MolecularWeight: 393.4589

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)CC(=O)NCC(=O)OC

Isomeric SMILES

C[NH+](CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)CC(=O)NCC(=O)OC

InChI

InChI=1S/C22H24N4O3/c1-25(16-20(27)23-13-21(28)29-2)14-18-15-26(19-11-7-4-8-12-19)24-22(18)17-9-5-3-6-10-17/h3-12,15H,13-14,16H2,1-2H3,(H,23,27)/p+1