2-[6-[5-(4-methylpiperazin-1-yl)pentoxy]naphthalen-2-yl]-1,3-benzoxazole hydrochloride

Systemtic Name: 2-[6-[5-(4-methylpiperazin-1-yl)pentoxy]naphthalen-2-yl]-1,3-benzoxazole hydrochloride Openeye Name: 2-[6-[5-(4-methylpiperazin-1-yl)pentoxy]-2-naphthyl]-1,3-benzoxazole hydrochloride CAS Name: 2-[6-[5-(4-methyl-1-piperazinyl)pentoxy]-2-naphthalenyl]-1,3-benzoxazole hydrochloride IUPAC Name: 2-[6-[5-(4-methylpiperazin-1-yl)pentoxy]naphthalen-2-yl]-1,3-benzoxazole hydrochloride Traditional Name: 2-[6-[5-(4-methylpiperazino)pentoxy]-2-naphthyl]-1,3-benzoxazole hydrochloride Formula: C27H32ClN3O2 MolecularWeight: 466.01488

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCCCOC2=CC3=C(C=C2)C=C(C=C3)C4=NC5=CC=CC=C5O4.Cl

Isomeric SMILES

CN1CCN(CC1)CCCCCOC2=CC3=C(C=C2)C=C(C=C3)C4=NC5=CC=CC=C5O4.Cl

InChI

InChI=1S/C27H31N3O2.ClH/c1-29-14-16-30(17-15-29)13-5-2-6-18-31-24-12-11-21-19-23(10-9-22(21)20-24)27-28-25-7-3-4-8-26(25)32-27;/h3-4,7-12,19-20H,2,5-6,13-18H2,1H3;1H