1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]ethanone Openeye Name: 1-[4-(1,3-benzoxazol-2-yl)-1-piperidyl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]ethanone CAS Name: 1-[4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-2-[4-(2-hydroxyphenyl)-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-[4-(1,3-benzoxazol-2-yl)piperidino]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]ethanone Formula: C24H29N4O3+ MolecularWeight: 421.51206

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3O2)C(=O)C[NH+]4CCN(CC4)C5=CC=CC=C5O

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3O2)C(=O)C[NH+]4CCN(CC4)C5=CC=CC=C5O

InChI

InChI=1S/C24H28N4O3/c29-21-7-3-2-6-20(21)27-15-13-26(14-16-27)17-23(30)28-11-9-18(10-12-28)24-25-19-5-1-4-8-22(19)31-24/h1-8,18,29H,9-17H2/p+1