2-[[3-(2-methoxyphenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[3-(2-methoxyphenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]ethyl-di(propan-2-yl)azanium Openeye Name: diisopropyl-[2-[[3-(2-methoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]amino]ethyl]ammonium CAS Name: 2-[[[3-(2-methoxyphenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[3-(2-methoxyphenyl)-1-phenylpyrazole-4-carbonyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: diisopropyl-[2-[[3-(2-methoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]amino]ethyl]ammonium Formula: C25H33N4O2+ MolecularWeight: 421.55512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(=O)C1=CN(N=C1C2=CC=CC=C2OC)C3=CC=CC=C3)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNC(=O)C1=CN(N=C1C2=CC=CC=C2OC)C3=CC=CC=C3)C(C)C

InChI

InChI=1S/C25H32N4O2/c1-18(2)28(19(3)4)16-15-26-25(30)22-17-29(20-11-7-6-8-12-20)27-24(22)21-13-9-10-14-23(21)31-5/h6-14,17-19H,15-16H2,1-5H3,(H,26,30)/p+1