1-[4-(2-hydroxyphenyl)carbonylpyrazol-1-yl]-3-(4-phenylpiperazin-1-ium-1-yl)propan-1-one

Systemtic Name: 1-[4-(2-hydroxyphenyl)carbonylpyrazol-1-yl]-3-(4-phenylpiperazin-1-ium-1-yl)propan-1-one Openeye Name: 1-[4-(2-hydroxybenzoyl)pyrazol-1-yl]-3-(4-phenylpiperazin-1-ium-1-yl)propan-1-one CAS Name: 1-[4-[(2-hydroxyphenyl)-oxomethyl]-1-pyrazolyl]-3-(4-phenyl-1-piperazin-1-iumyl)-1-propanone IUPAC Name: 1-[4-(2-hydroxybenzoyl)pyrazol-1-yl]-3-(4-phenylpiperazin-1-ium-1-yl)propan-1-one Traditional Name: 3-(4-phenylpiperazin-1-ium-1-yl)-1-(4-salicyloylpyrazol-1-yl)propan-1-one Formula: C23H25N4O3+ MolecularWeight: 405.4696

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)N2C=C(C=N2)C(=O)C3=CC=CC=C3O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)N2C=C(C=N2)C(=O)C3=CC=CC=C3O)C4=CC=CC=C4

InChI

InChI=1S/C23H24N4O3/c28-21-9-5-4-8-20(21)23(30)18-16-24-27(17-18)22(29)10-11-25-12-14-26(15-13-25)19-6-2-1-3-7-19/h1-9,16-17,28H,10-15H2/p+1