[5-(1,3-benzodioxol-5-yl)-3-propoxy-1,2,4-triazol-1-yl]-(2-methylphenyl)methanone

Systemtic Name: [5-(1,3-benzodioxol-5-yl)-3-propoxy-1,2,4-triazol-1-yl]-(2-methylphenyl)methanone Openeye Name: [5-(1,3-benzodioxol-5-yl)-3-propoxy-1,2,4-triazol-1-yl]-(o-tolyl)methanone CAS Name: [5-(1,3-benzodioxol-5-yl)-3-propoxy-1,2,4-triazol-1-yl]-(2-methylphenyl)methanone IUPAC Name: [5-(1,3-benzodioxol-5-yl)-3-propoxy-1,2,4-triazol-1-yl]-(2-methylphenyl)methanone Traditional Name: [5-(1,3-benzodioxol-5-yl)-3-propoxy-1,2,4-triazol-1-yl]-(o-tolyl)methanone Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NN(C(=N1)C2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4C

Isomeric SMILES

CCCOC1=NN(C(=N1)C2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4C

InChI

InChI=1S/C20H19N3O4/c1-3-10-25-20-21-18(14-8-9-16-17(11-14)27-12-26-16)23(22-20)19(24)15-7-5-4-6-13(15)2/h4-9,11H,3,10,12H2,1-2H3