6-[2-(4-quinolin-8-ylpiperazin-1-yl)ethyl]-3H-1,3-benzoxazol-2-one hydrochloride

Systemtic Name: 6-[2-(4-quinolin-8-ylpiperazin-1-yl)ethyl]-3H-1,3-benzoxazol-2-one hydrochloride Openeye Name: 6-[2-[4-(8-quinolyl)piperazin-1-yl]ethyl]-3H-1,3-benzoxazol-2-one hydrochloride CAS Name: 6-[2-[4-(8-quinolinyl)-1-piperazinyl]ethyl]-3H-1,3-benzoxazol-2-one hydrochloride IUPAC Name: 6-[2-(4-quinolin-8-ylpiperazin-1-yl)ethyl]-3H-1,3-benzoxazol-2-one hydrochloride Traditional Name: 6-[2-[4-(8-quinolyl)piperazino]ethyl]-3H-1,3-benzoxazol-2-one hydrochloride Formula: C22H23ClN4O2 MolecularWeight: 410.89662

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC3=C(C=C2)NC(=O)O3)C4=CC=CC5=C4N=CC=C5.Cl

Isomeric SMILES

C1CN(CCN1CCC2=CC3=C(C=C2)NC(=O)O3)C4=CC=CC5=C4N=CC=C5.Cl

InChI

InChI=1S/C22H22N4O2.ClH/c27-22-24-18-7-6-16(15-20(18)28-22)8-10-25-11-13-26(14-12-25)19-5-1-3-17-4-2-9-23-21(17)19;/h1-7,9,15H,8,10-14H2,(H,24,27);1H