3-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]-2H-1,3-benzoxazin-4-one hydrochloride

Systemtic Name: 3-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]-2H-1,3-benzoxazin-4-one hydrochloride Openeye Name: 3-[2-[4-(o-tolyl)piperazin-1-yl]ethyl]-2H-1,3-benzoxazin-4-one hydrochloride CAS Name: 3-[2-[4-(2-methylphenyl)-1-piperazinyl]ethyl]-2H-1,3-benzoxazin-4-one hydrochloride IUPAC Name: 3-[2-[4-(2-methylphenyl)piperazin-1-yl]ethyl]-2H-1,3-benzoxazin-4-one hydrochloride Traditional Name: 3-[2-[4-(o-tolyl)piperazino]ethyl]-2H-1,3-benzoxazin-4-one hydrochloride Formula: C21H26ClN3O2 MolecularWeight: 387.90304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)CCN3COC4=CC=CC=C4C3=O.Cl

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)CCN3COC4=CC=CC=C4C3=O.Cl

InChI

InChI=1S/C21H25N3O2.ClH/c1-17-6-2-4-8-19(17)23-13-10-22(11-14-23)12-15-24-16-26-20-9-5-3-7-18(20)21(24)25;/h2-9H,10-16H2,1H3;1H