2-[4-[2-[8-(4-methylpiperazin-1-yl)naphthalen-2-yl]oxyethanoyl]piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-[4-[2-[8-(4-methylpiperazin-1-yl)naphthalen-2-yl]oxyethanoyl]piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-[4-[2-[[8-(4-methylpiperazin-1-yl)-2-naphthyl]oxy]acetyl]piperazin-1-yl]benzonitrile CAS Name: 2-[4-[2-[[8-(4-methyl-1-piperazinyl)-2-naphthalenyl]oxy]-1-oxoethyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-[4-[2-[8-(4-methylpiperazin-1-yl)naphthalen-2-yl]oxyacetyl]piperazin-1-yl]benzonitrile Traditional Name: 2-[4-[2-[8-(4-methylpiperazino)-2-naphthoxy]acetyl]piperazino]benzonitrile Formula: C28H31N5O2 MolecularWeight: 469.57804

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC3=C2C=C(C=C3)OCC(=O)N4CCN(CC4)C5=CC=CC=C5C#N

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC3=C2C=C(C=C3)OCC(=O)N4CCN(CC4)C5=CC=CC=C5C#N

InChI

InChI=1S/C28H31N5O2/c1-30-11-13-32(14-12-30)27-8-4-6-22-9-10-24(19-25(22)27)35-21-28(34)33-17-15-31(16-18-33)26-7-3-2-5-23(26)20-29/h2-10,19H,11-18,21H2,1H3