3-[4-(4-phenylpiperazin-1-yl)butyl]-2H-1,3-benzoxazin-4-one dihydrochloride

Systemtic Name: 3-[4-(4-phenylpiperazin-1-yl)butyl]-2H-1,3-benzoxazin-4-one dihydrochloride Openeye Name: 3-[4-(4-phenylpiperazin-1-yl)butyl]-2H-1,3-benzoxazin-4-one dihydrochloride CAS Name: 3-[4-(4-phenyl-1-piperazinyl)butyl]-2H-1,3-benzoxazin-4-one dihydrochloride IUPAC Name: 3-[4-(4-phenylpiperazin-1-yl)butyl]-2H-1,3-benzoxazin-4-one dihydrochloride Traditional Name: 3-[4-(4-phenylpiperazino)butyl]-2H-1,3-benzoxazin-4-one dihydrochloride Formula: C22H29Cl2N3O2 MolecularWeight: 438.39056

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2COC3=CC=CC=C3C2=O)C4=CC=CC=C4.Cl.Cl

Isomeric SMILES

C1CN(CCN1CCCCN2COC3=CC=CC=C3C2=O)C4=CC=CC=C4.Cl.Cl

InChI

InChI=1S/C22H27N3O2.2ClH/c26-22-20-10-4-5-11-21(20)27-18-25(22)13-7-6-12-23-14-16-24(17-15-23)19-8-2-1-3-9-19;;/h1-5,8-11H,6-7,12-18H2;2*1H