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

Systemtic Name: aziridin-1-yl-[6-(1,3-benzodioxol-5-yl)-6-phenyl-1,7-dihydroindazol-3-yl]methanone Openeye Name: aziridin-1-yl-[6-(1,3-benzodioxol-5-yl)-6-phenyl-1,7-dihydroindazol-3-yl]methanone CAS Name: 1-aziridinyl-[6-(1,3-benzodioxol-5-yl)-6-phenyl-1,7-dihydroindazol-3-yl]methanone IUPAC Name: aziridin-1-yl-[6-(1,3-benzodioxol-5-yl)-6-phenyl-1,7-dihydroindazol-3-yl]methanone Traditional Name: [6-(1,3-benzodioxol-5-yl)-6-phenyl-1,7-dihydroindazol-3-yl]-ethylenimino-methanone Formula: C23H19N3O3 MolecularWeight: 385.41526

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Descriptors Computed from Structure

Canonical SMILES:

C1CN1C(=O)C2=NNC3=C2C=CC(C3)(C4=CC=CC=C4)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CN1C(=O)C2=NNC3=C2C=CC(C3)(C4=CC=CC=C4)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C23H19N3O3/c27-22(26-10-11-26)21-17-8-9-23(13-18(17)24-25-21,15-4-2-1-3-5-15)16-6-7-19-20(12-16)29-14-28-19/h1-9,12H,10-11,13-14H2,(H,24,25)