1-(anthracen-9-ylmethyl)-4-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-1,2,3-triazole

Systemtic Name: 1-(anthracen-9-ylmethyl)-4-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-1,2,3-triazole Openeye Name: 1-(9-anthrylmethyl)-4-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]triazole CAS Name: 1-(9-anthracenylmethyl)-4-[3-methoxy-4-(4-methyl-1-imidazolyl)phenyl]triazole IUPAC Name: 1-(anthracen-9-ylmethyl)-4-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]triazole Traditional Name: 1-(9-anthrylmethyl)-4-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]triazole Formula: C28H23N5O MolecularWeight: 445.51512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C=N1)C2=C(C=C(C=C2)C3=CN(N=N3)CC4=C5C=CC=CC5=CC6=CC=CC=C64)OC

Isomeric SMILES

CC1=CN(C=N1)C2=C(C=C(C=C2)C3=CN(N=N3)CC4=C5C=CC=CC5=CC6=CC=CC=C64)OC

InChI

InChI=1S/C28H23N5O/c1-19-15-32(18-29-19)27-12-11-22(14-28(27)34-2)26-17-33(31-30-26)16-25-23-9-5-3-7-20(23)13-21-8-4-6-10-24(21)25/h3-15,17-18H,16H2,1-2H3