1-(benzotriazol-1-yl)-3-[4-(4-pentoxyphenyl)phenyl]propan-1-one

Systemtic Name: 1-(benzotriazol-1-yl)-3-[4-(4-pentoxyphenyl)phenyl]propan-1-one Openeye Name: 1-(benzotriazol-1-yl)-3-[4-(4-pentoxyphenyl)phenyl]propan-1-one CAS Name: 1-(1-benzotriazolyl)-3-[4-(4-pentoxyphenyl)phenyl]-1-propanone IUPAC Name: 1-(benzotriazol-1-yl)-3-[4-(4-pentoxyphenyl)phenyl]propan-1-one Traditional Name: 3-[4-(4-amoxyphenyl)phenyl]-1-(benzotriazol-1-yl)propan-1-one Formula: C26H27N3O2 MolecularWeight: 413.51148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)CCC(=O)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)CCC(=O)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C26H27N3O2/c1-2-3-6-19-31-23-16-14-22(15-17-23)21-12-9-20(10-13-21)11-18-26(30)29-25-8-5-4-7-24(25)27-28-29/h4-5,7-10,12-17H,2-3,6,11,18-19H2,1H3