1-carbazol-9-yl-8-(4-pyridin-3-yl-1,2,3-triazol-1-yl)octan-1-one

Systemtic Name: 1-carbazol-9-yl-8-(4-pyridin-3-yl-1,2,3-triazol-1-yl)octan-1-one Openeye Name: 1-carbazol-9-yl-8-[4-(3-pyridyl)triazol-1-yl]octan-1-one CAS Name: 1-(9-carbazolyl)-8-[4-(3-pyridinyl)-1-triazolyl]-1-octanone IUPAC Name: 1-carbazol-9-yl-8-(4-pyridin-3-yltriazol-1-yl)octan-1-one Traditional Name: 1-carbazol-9-yl-8-[4-(3-pyridyl)triazol-1-yl]octan-1-one Formula: C27H27N5O MolecularWeight: 437.53618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=CC=CC=C3N2C(=O)CCCCCCCN4C=C(N=N4)C5=CN=CC=C5

Isomeric SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3N2C(=O)CCCCCCCN4C=C(N=N4)C5=CN=CC=C5

InChI

InChI=1S/C27H27N5O/c33-27(32-25-14-7-5-12-22(25)23-13-6-8-15-26(23)32)16-4-2-1-3-9-18-31-20-24(29-30-31)21-11-10-17-28-19-21/h5-8,10-15,17,19-20H,1-4,9,16,18H2