5-(1,3-benzodioxol-5-yl)-3-ethoxy-1-naphthalen-1-ylsulfonyl-1,2,4-triazole

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-3-ethoxy-1-naphthalen-1-ylsulfonyl-1,2,4-triazole Openeye Name: 5-(1,3-benzodioxol-5-yl)-3-ethoxy-1-(1-naphthylsulfonyl)-1,2,4-triazole CAS Name: 5-(1,3-benzodioxol-5-yl)-3-ethoxy-1-(1-naphthalenylsulfonyl)-1,2,4-triazole IUPAC Name: 5-(1,3-benzodioxol-5-yl)-3-ethoxy-1-naphthalen-1-ylsulfonyl-1,2,4-triazole Traditional Name: 5-(1,3-benzodioxol-5-yl)-3-ethoxy-1-(1-naphthylsulfonyl)-1,2,4-triazole Formula: C21H17N3O5S MolecularWeight: 423.44178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C(=N1)C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCOC1=NN(C(=N1)C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C21H17N3O5S/c1-2-27-21-22-20(15-10-11-17-18(12-15)29-13-28-17)24(23-21)30(25,26)19-9-5-7-14-6-3-4-8-16(14)19/h3-12H,2,13H2,1H3