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

Systemtic Name: N-[4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-2H-1,4-benzoxazin-3-amine tetrahydrochloride Openeye Name: N-[4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-2H-1,4-benzoxazin-3-amine tetrahydrochloride CAS Name: N-[4-[3-(4-phenyl-1-piperazinyl)propoxy]phenyl]-2H-1,4-benzoxazin-3-amine tetrahydrochloride IUPAC Name: N-[4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]-2H-1,4-benzoxazin-3-amine tetrahydrochloride Traditional Name: 2H-1,4-benzoxazin-3-yl-[4-[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=C(C=C2)NC3=NC4=CC=CC=C4OC3)C5=CC=CC=C5.Cl.Cl.Cl.Cl

Isomeric SMILES

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

InChI

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