4-[(2-chlorophenyl)methyl]-6-fluoranyl-8-piperazin-1-yl-1,4-benzoxazin-3-one hydrochloride

Systemtic Name: 4-[(2-chlorophenyl)methyl]-6-fluoranyl-8-piperazin-1-yl-1,4-benzoxazin-3-one hydrochloride Openeye Name: 4-[(2-chlorophenyl)methyl]-6-fluoro-8-piperazin-1-yl-1,4-benzoxazin-3-one hydrochloride CAS Name: 4-[(2-chlorophenyl)methyl]-6-fluoro-8-(1-piperazinyl)-1,4-benzoxazin-3-one hydrochloride IUPAC Name: 4-[(2-chlorophenyl)methyl]-6-fluoro-8-piperazin-1-yl-1,4-benzoxazin-3-one hydrochloride Traditional Name: 4-(2-chlorobenzyl)-6-fluoro-8-piperazino-1,4-benzoxazin-3-one hydrochloride Formula: C19H20Cl2FN3O2 MolecularWeight: 412.285403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C3C(=CC(=C2)F)N(C(=O)CO3)CC4=CC=CC=C4Cl.Cl

Isomeric SMILES

C1CN(CCN1)C2=C3C(=CC(=C2)F)N(C(=O)CO3)CC4=CC=CC=C4Cl.Cl

InChI

InChI=1S/C19H19ClFN3O2.ClH/c20-15-4-2-1-3-13(15)11-24-17-10-14(21)9-16(19(17)26-12-18(24)25)23-7-5-22-6-8-23;/h1-4,9-10,22H,5-8,11-12H2;1H