1-[2,3-bis(chloranyl)phenyl]-4-[4-[4-(1,2,3-triazol-1-ylmethyl)phenoxy]butyl]piperazine

Systemtic Name: 1-[2,3-bis(chloranyl)phenyl]-4-[4-[4-(1,2,3-triazol-1-ylmethyl)phenoxy]butyl]piperazine Openeye Name: 1-(2,3-dichlorophenyl)-4-[4-[4-(triazol-1-ylmethyl)phenoxy]butyl]piperazine CAS Name: 1-(2,3-dichlorophenyl)-4-[4-[4-(1-triazolylmethyl)phenoxy]butyl]piperazine IUPAC Name: 1-(2,3-dichlorophenyl)-4-[4-[4-(triazol-1-ylmethyl)phenoxy]butyl]piperazine Traditional Name: 1-(2,3-dichlorophenyl)-4-[4-[4-(triazol-1-ylmethyl)phenoxy]butyl]piperazine Formula: C23H27Cl2N5O MolecularWeight: 460.39938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCOC2=CC=C(C=C2)CN3C=CN=N3)C4=C(C(=CC=C4)Cl)Cl

Isomeric SMILES

C1CN(CCN1CCCCOC2=CC=C(C=C2)CN3C=CN=N3)C4=C(C(=CC=C4)Cl)Cl

InChI

InChI=1S/C23H27Cl2N5O/c24-21-4-3-5-22(23(21)25)29-15-13-28(14-16-29)11-1-2-17-31-20-8-6-19(7-9-20)18-30-12-10-26-27-30/h3-10,12H,1-2,11,13-18H2