[5-(1,3-benzodioxol-5-yl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]-(2-phenylcyclopropyl)methanone

Systemtic Name: [5-(1,3-benzodioxol-5-yl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]-(2-phenylcyclopropyl)methanone Openeye Name: [5-(1,3-benzodioxol-5-yl)-3-isopropoxy-1,2,4-triazol-1-yl]-(2-phenylcyclopropyl)methanone CAS Name: [5-(1,3-benzodioxol-5-yl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]-(2-phenylcyclopropyl)methanone IUPAC Name: [5-(1,3-benzodioxol-5-yl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]-(2-phenylcyclopropyl)methanone Traditional Name: [5-(1,3-benzodioxol-5-yl)-3-isopropoxy-1,2,4-triazol-1-yl]-(2-phenylcyclopropyl)methanone Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NN(C(=N1)C2=CC3=C(C=C2)OCO3)C(=O)C4CC4C5=CC=CC=C5

Isomeric SMILES

CC(C)OC1=NN(C(=N1)C2=CC3=C(C=C2)OCO3)C(=O)C4CC4C5=CC=CC=C5

InChI

InChI=1S/C22H21N3O4/c1-13(2)29-22-23-20(15-8-9-18-19(10-15)28-12-27-18)25(24-22)21(26)17-11-16(17)14-6-4-3-5-7-14/h3-10,13,16-17H,11-12H2,1-2H3