2-[1-[3-(diethylamino)propyl]-4-(4-hydroxyphenyl)-5-phenyl-pyrazol-1-ium-1-yl]ethanamide

Systemtic Name: 2-[1-[3-(diethylamino)propyl]-4-(4-hydroxyphenyl)-5-phenyl-pyrazol-1-ium-1-yl]ethanamide Openeye Name: 2-[1-[3-(diethylamino)propyl]-4-(4-hydroxyphenyl)-5-phenyl-pyrazol-1-ium-1-yl]acetamide CAS Name: 2-[1-[3-(diethylamino)propyl]-4-(4-hydroxyphenyl)-5-phenyl-1-pyrazol-1-iumyl]acetamide IUPAC Name: 2-[1-[3-(diethylamino)propyl]-4-(4-hydroxyphenyl)-5-phenylpyrazol-1-ium-1-yl]acetamide Traditional Name: 2-[1-[3-(diethylamino)propyl]-4-(4-hydroxyphenyl)-5-phenyl-pyrazol-1-ium-1-yl]acetamide Formula: C24H31N4O2+ MolecularWeight: 407.52854

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC[N+]1(C(=C(C=N1)C2=CC=C(C=C2)O)C3=CC=CC=C3)CC(=O)N

Isomeric SMILES

CCN(CC)CCC[N+]1(C(=C(C=N1)C2=CC=C(C=C2)O)C3=CC=CC=C3)CC(=O)N

InChI

InChI=1S/C24H30N4O2/c1-3-27(4-2)15-8-16-28(18-23(25)30)24(20-9-6-5-7-10-20)22(17-26-28)19-11-13-21(29)14-12-19/h5-7,9-14,17H,3-4,8,15-16,18H2,1-2H3,(H2-,25,29,30)/p+1