2-[[5-(furan-2-yl)-2-phenyl-pyrazol-3-yl]carbonyl-(phenylmethyl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[5-(furan-2-yl)-2-phenyl-pyrazol-3-yl]carbonyl-(phenylmethyl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[benzyl-[5-(2-furyl)-2-phenyl-pyrazole-3-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[5-(2-furanyl)-2-phenyl-3-pyrazolyl]-oxomethyl]-(phenylmethyl)amino]ethyl-dimethylammonium IUPAC Name: 2-[benzyl-[5-(furan-2-yl)-2-phenylpyrazole-3-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[benzyl-[5-(2-furyl)-2-phenyl-pyrazole-3-carbonyl]amino]ethyl-dimethyl-ammonium Formula: C25H27N4O2+ MolecularWeight: 415.50748

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN(CC1=CC=CC=C1)C(=O)C2=CC(=NN2C3=CC=CC=C3)C4=CC=CO4

Isomeric SMILES

C[NH+](C)CCN(CC1=CC=CC=C1)C(=O)C2=CC(=NN2C3=CC=CC=C3)C4=CC=CO4

InChI

InChI=1S/C25H26N4O2/c1-27(2)15-16-28(19-20-10-5-3-6-11-20)25(30)23-18-22(24-14-9-17-31-24)26-29(23)21-12-7-4-8-13-21/h3-14,17-18H,15-16,19H2,1-2H3/p+1