N-[3-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-2H-1,4-benzoxazin-3-amine tetrahydrochloride

Systemtic Name: N-[3-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-2H-1,4-benzoxazin-3-amine tetrahydrochloride Openeye Name: N-[3-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-2H-1,4-benzoxazin-3-amine tetrahydrochloride CAS Name: N-[3-[3-(4-phenyl-1-piperazinyl)propoxy]phenyl]-2H-1,4-benzoxazin-3-amine tetrahydrochloride IUPAC Name: N-[3-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-2H-1,4-benzoxazin-3-amine tetrahydrochloride Traditional Name: 2H-1,4-benzoxazin-3-yl-[3-[3-(4-phenylpiperazino)propoxy]phenyl]amine tetrahydrochloride Formula: C27H34Cl4N4O2 MolecularWeight: 588.39646

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC2=CC=CC(=C2)NC3=NC4=CC=CC=C4OC3)C5=CC=CC=C5.Cl.Cl.Cl.Cl

Isomeric SMILES

C1CN(CCN1CCCOC2=CC=CC(=C2)NC3=NC4=CC=CC=C4OC3)C5=CC=CC=C5.Cl.Cl.Cl.Cl

InChI

InChI=1S/C27H30N4O2.4ClH/c1-2-9-23(10-3-1)31-17-15-30(16-18-31)14-7-19-32-24-11-6-8-22(20-24)28-27-21-33-26-13-5-4-12-25(26)29-27;;;;/h1-6,8-13,20H,7,14-19,21H2,(H,28,29);4*1H