aziridin-1-yl-[6-phenyl-6-(3,4,5-trimethoxyphenyl)-1,7-dihydroindazol-3-yl]methanone

Systemtic Name: aziridin-1-yl-[6-phenyl-6-(3,4,5-trimethoxyphenyl)-1,7-dihydroindazol-3-yl]methanone Openeye Name: aziridin-1-yl-[6-phenyl-6-(3,4,5-trimethoxyphenyl)-1,7-dihydroindazol-3-yl]methanone CAS Name: 1-aziridinyl-[6-phenyl-6-(3,4,5-trimethoxyphenyl)-1,7-dihydroindazol-3-yl]methanone IUPAC Name: aziridin-1-yl-[6-phenyl-6-(3,4,5-trimethoxyphenyl)-1,7-dihydroindazol-3-yl]methanone Traditional Name: ethylenimino-[6-phenyl-6-(3,4,5-trimethoxyphenyl)-1,7-dihydroindazol-3-yl]methanone Formula: C25H25N3O4 MolecularWeight: 431.4837

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2(CC3=C(C=C2)C(=NN3)C(=O)N4CC4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2(CC3=C(C=C2)C(=NN3)C(=O)N4CC4)C5=CC=CC=C5

InChI

InChI=1S/C25H25N3O4/c1-30-20-13-17(14-21(31-2)23(20)32-3)25(16-7-5-4-6-8-16)10-9-18-19(15-25)26-27-22(18)24(29)28-11-12-28/h4-10,13-14H,11-12,15H2,1-3H3,(H,26,27)