azetidin-1-yl-[6-phenyl-6-(2,3,4-trimethoxyphenyl)-1,7-dihydroindazol-3-yl]methanone

Systemtic Name: azetidin-1-yl-[6-phenyl-6-(2,3,4-trimethoxyphenyl)-1,7-dihydroindazol-3-yl]methanone Openeye Name: azetidin-1-yl-[6-phenyl-6-(2,3,4-trimethoxyphenyl)-1,7-dihydroindazol-3-yl]methanone CAS Name: 1-azetidinyl-[6-phenyl-6-(2,3,4-trimethoxyphenyl)-1,7-dihydroindazol-3-yl]methanone IUPAC Name: azetidin-1-yl-[6-phenyl-6-(2,3,4-trimethoxyphenyl)-1,7-dihydroindazol-3-yl]methanone Traditional Name: azetidin-1-yl-[6-phenyl-6-(2,3,4-trimethoxyphenyl)-1,7-dihydroindazol-3-yl]methanone Formula: C26H27N3O4 MolecularWeight: 445.51028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2(CC3=C(C=C2)C(=NN3)C(=O)N4CCC4)C5=CC=CC=C5)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2(CC3=C(C=C2)C(=NN3)C(=O)N4CCC4)C5=CC=CC=C5)OC)OC

InChI

InChI=1S/C26H27N3O4/c1-31-21-11-10-19(23(32-2)24(21)33-3)26(17-8-5-4-6-9-17)13-12-18-20(16-26)27-28-22(18)25(30)29-14-7-15-29/h4-6,8-13H,7,14-16H2,1-3H3,(H,27,28)